Derivative Name / Structure | SMILES | Kovats RI Value | Column Type | Reference |
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3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,1TMS,isomer #1 | C[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(NC2=CC=C3NC(=O)CCC3=C2)=NC=C1C(F)(F)F | 4068.2 | Semi standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,1TMS,isomer #1 | C[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(NC2=CC=C3NC(=O)CCC3=C2)=NC=C1C(F)(F)F | 3633.5 | Standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,1TMS,isomer #1 | C[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(NC2=CC=C3NC(=O)CCC3=C2)=NC=C1C(F)(F)F | 5251.8 | Standard polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,1TMS,isomer #2 | C[Si](C)(C)N(C1=CC=C2NC(=O)CCC2=C1)C1=NC=C(C(F)(F)F)C(NCC2=CC=CC(S(C)(=O)=O)=C2)=N1 | 4025.1 | Semi standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,1TMS,isomer #2 | C[Si](C)(C)N(C1=CC=C2NC(=O)CCC2=C1)C1=NC=C(C(F)(F)F)C(NCC2=CC=CC(S(C)(=O)=O)=C2)=N1 | 3562.1 | Standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,1TMS,isomer #2 | C[Si](C)(C)N(C1=CC=C2NC(=O)CCC2=C1)C1=NC=C(C(F)(F)F)C(NCC2=CC=CC(S(C)(=O)=O)=C2)=N1 | 5093.1 | Standard polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,1TMS,isomer #3 | C[Si](C)(C)N1C(=O)CCC2=CC(NC3=NC=C(C(F)(F)F)C(NCC4=CC=CC(S(C)(=O)=O)=C4)=N3)=CC=C21 | 4061.2 | Semi standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,1TMS,isomer #3 | C[Si](C)(C)N1C(=O)CCC2=CC(NC3=NC=C(C(F)(F)F)C(NCC4=CC=CC(S(C)(=O)=O)=C4)=N3)=CC=C21 | 3642.9 | Standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,1TMS,isomer #3 | C[Si](C)(C)N1C(=O)CCC2=CC(NC3=NC=C(C(F)(F)F)C(NCC4=CC=CC(S(C)(=O)=O)=C4)=N3)=CC=C21 | 5105.2 | Standard polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,2TMS,isomer #1 | C[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(N(C2=CC=C3NC(=O)CCC3=C2)[Si](C)(C)C)=NC=C1C(F)(F)F | 3927.3 | Semi standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,2TMS,isomer #1 | C[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(N(C2=CC=C3NC(=O)CCC3=C2)[Si](C)(C)C)=NC=C1C(F)(F)F | 3688.0 | Standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,2TMS,isomer #1 | C[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(N(C2=CC=C3NC(=O)CCC3=C2)[Si](C)(C)C)=NC=C1C(F)(F)F | 4681.0 | Standard polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,2TMS,isomer #2 | C[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(NC2=CC=C3C(=C2)CCC(=O)N3[Si](C)(C)C)=NC=C1C(F)(F)F | 3864.2 | Semi standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,2TMS,isomer #2 | C[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(NC2=CC=C3C(=C2)CCC(=O)N3[Si](C)(C)C)=NC=C1C(F)(F)F | 3774.0 | Standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,2TMS,isomer #2 | C[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(NC2=CC=C3C(=C2)CCC(=O)N3[Si](C)(C)C)=NC=C1C(F)(F)F | 4690.0 | Standard polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,2TMS,isomer #3 | C[Si](C)(C)N1C(=O)CCC2=CC(N(C3=NC=C(C(F)(F)F)C(NCC4=CC=CC(S(C)(=O)=O)=C4)=N3)[Si](C)(C)C)=CC=C21 | 3854.0 | Semi standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,2TMS,isomer #3 | C[Si](C)(C)N1C(=O)CCC2=CC(N(C3=NC=C(C(F)(F)F)C(NCC4=CC=CC(S(C)(=O)=O)=C4)=N3)[Si](C)(C)C)=CC=C21 | 3710.8 | Standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,2TMS,isomer #3 | C[Si](C)(C)N1C(=O)CCC2=CC(N(C3=NC=C(C(F)(F)F)C(NCC4=CC=CC(S(C)(=O)=O)=C4)=N3)[Si](C)(C)C)=CC=C21 | 4556.3 | Standard polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,3TMS,isomer #1 | C[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(N(C2=CC=C3C(=C2)CCC(=O)N3[Si](C)(C)C)[Si](C)(C)C)=NC=C1C(F)(F)F | 3724.4 | Semi standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,3TMS,isomer #1 | C[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(N(C2=CC=C3C(=C2)CCC(=O)N3[Si](C)(C)C)[Si](C)(C)C)=NC=C1C(F)(F)F | 3831.7 | Standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,3TMS,isomer #1 | C[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(N(C2=CC=C3C(=C2)CCC(=O)N3[Si](C)(C)C)[Si](C)(C)C)=NC=C1C(F)(F)F | 4191.0 | Standard polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,1TBDMS,isomer #1 | CC(C)(C)[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(NC2=CC=C3NC(=O)CCC3=C2)=NC=C1C(F)(F)F | 4314.7 | Semi standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,1TBDMS,isomer #1 | CC(C)(C)[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(NC2=CC=C3NC(=O)CCC3=C2)=NC=C1C(F)(F)F | 3850.0 | Standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,1TBDMS,isomer #1 | CC(C)(C)[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(NC2=CC=C3NC(=O)CCC3=C2)=NC=C1C(F)(F)F | 5244.1 | Standard polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,1TBDMS,isomer #2 | CC(C)(C)[Si](C)(C)N(C1=CC=C2NC(=O)CCC2=C1)C1=NC=C(C(F)(F)F)C(NCC2=CC=CC(S(C)(=O)=O)=C2)=N1 | 4298.9 | Semi standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,1TBDMS,isomer #2 | CC(C)(C)[Si](C)(C)N(C1=CC=C2NC(=O)CCC2=C1)C1=NC=C(C(F)(F)F)C(NCC2=CC=CC(S(C)(=O)=O)=C2)=N1 | 3777.5 | Standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,1TBDMS,isomer #2 | CC(C)(C)[Si](C)(C)N(C1=CC=C2NC(=O)CCC2=C1)C1=NC=C(C(F)(F)F)C(NCC2=CC=CC(S(C)(=O)=O)=C2)=N1 | 5065.5 | Standard polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,1TBDMS,isomer #3 | CC(C)(C)[Si](C)(C)N1C(=O)CCC2=CC(NC3=NC=C(C(F)(F)F)C(NCC4=CC=CC(S(C)(=O)=O)=C4)=N3)=CC=C21 | 4347.2 | Semi standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,1TBDMS,isomer #3 | CC(C)(C)[Si](C)(C)N1C(=O)CCC2=CC(NC3=NC=C(C(F)(F)F)C(NCC4=CC=CC(S(C)(=O)=O)=C4)=N3)=CC=C21 | 3871.8 | Standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,1TBDMS,isomer #3 | CC(C)(C)[Si](C)(C)N1C(=O)CCC2=CC(NC3=NC=C(C(F)(F)F)C(NCC4=CC=CC(S(C)(=O)=O)=C4)=N3)=CC=C21 | 5072.1 | Standard polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,2TBDMS,isomer #1 | CC(C)(C)[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(N(C2=CC=C3NC(=O)CCC3=C2)[Si](C)(C)C(C)(C)C)=NC=C1C(F)(F)F | 4361.6 | Semi standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,2TBDMS,isomer #1 | CC(C)(C)[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(N(C2=CC=C3NC(=O)CCC3=C2)[Si](C)(C)C(C)(C)C)=NC=C1C(F)(F)F | 4097.4 | Standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,2TBDMS,isomer #1 | CC(C)(C)[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(N(C2=CC=C3NC(=O)CCC3=C2)[Si](C)(C)C(C)(C)C)=NC=C1C(F)(F)F | 4722.6 | Standard polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,2TBDMS,isomer #2 | CC(C)(C)[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(NC2=CC=C3C(=C2)CCC(=O)N3[Si](C)(C)C(C)(C)C)=NC=C1C(F)(F)F | 4328.1 | Semi standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,2TBDMS,isomer #2 | CC(C)(C)[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(NC2=CC=C3C(=C2)CCC(=O)N3[Si](C)(C)C(C)(C)C)=NC=C1C(F)(F)F | 4204.7 | Standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,2TBDMS,isomer #2 | CC(C)(C)[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(NC2=CC=C3C(=C2)CCC(=O)N3[Si](C)(C)C(C)(C)C)=NC=C1C(F)(F)F | 4722.7 | Standard polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,2TBDMS,isomer #3 | CC(C)(C)[Si](C)(C)N1C(=O)CCC2=CC(N(C3=NC=C(C(F)(F)F)C(NCC4=CC=CC(S(C)(=O)=O)=C4)=N3)[Si](C)(C)C(C)(C)C)=CC=C21 | 4333.0 | Semi standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,2TBDMS,isomer #3 | CC(C)(C)[Si](C)(C)N1C(=O)CCC2=CC(N(C3=NC=C(C(F)(F)F)C(NCC4=CC=CC(S(C)(=O)=O)=C4)=N3)[Si](C)(C)C(C)(C)C)=CC=C21 | 4142.4 | Standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,2TBDMS,isomer #3 | CC(C)(C)[Si](C)(C)N1C(=O)CCC2=CC(N(C3=NC=C(C(F)(F)F)C(NCC4=CC=CC(S(C)(=O)=O)=C4)=N3)[Si](C)(C)C(C)(C)C)=CC=C21 | 4582.5 | Standard polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,3TBDMS,isomer #1 | CC(C)(C)[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(N(C2=CC=C3C(=C2)CCC(=O)N3[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)=NC=C1C(F)(F)F | 4370.5 | Semi standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,3TBDMS,isomer #1 | CC(C)(C)[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(N(C2=CC=C3C(=C2)CCC(=O)N3[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)=NC=C1C(F)(F)F | 4456.0 | Standard non polar | 33892256 |
3,4-Dihydro-6-[[4-[[[3-(methylsulfonyl)phenyl]methyl]amino]-5-(trifluoromethyl)-2-pyrimidinyl]amino]-2(1H)-quinolinone,3TBDMS,isomer #1 | CC(C)(C)[Si](C)(C)N(CC1=CC=CC(S(C)(=O)=O)=C1)C1=NC(N(C2=CC=C3C(=C2)CCC(=O)N3[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C)=NC=C1C(F)(F)F | 4302.5 | Standard polar | 33892256 |