HMDB0244337 RDKit 3D N-(6-Methoxy-8-quinolyl)-4-toluenesulfonamide 39 41 0 0 0 0 0 0 0 0999 V2000 -2.2023 3.4484 1.0461 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2444 2.4150 0.9159 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6198 1.1393 0.4816 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6705 0.1250 0.3554 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0404 -1.1189 -0.0694 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1300 -2.1887 -0.1950 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3111 -2.1410 -1.1207 S 0 0 0 0 0 6 0 0 0 0 0 0 1.9555 -3.5087 -1.1457 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 -1.8764 -2.5784 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3887 -0.9289 -0.5341 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5519 0.3307 -1.1043 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4281 1.2655 -0.5961 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1730 0.9450 0.5189 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1285 1.9521 1.0806 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0447 -0.2841 1.1134 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1547 -1.2049 0.5797 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3658 -1.3879 -0.3794 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7226 -2.6127 -0.7958 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9855 -2.9416 -1.1121 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9382 -1.9513 -0.9931 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6333 -0.6883 -0.5748 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3254 -0.3869 -0.2585 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9285 0.8588 0.1709 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0183 3.0492 1.6876 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7071 4.2825 1.5847 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 3.8059 0.0759 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 0.3666 0.6187 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3242 -3.1143 0.3144 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9522 0.5384 -1.9711 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5409 2.2551 -1.0631 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8814 1.4297 1.6982 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5996 2.7381 1.6504 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5899 2.4549 0.2023 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6521 -0.4803 1.9827 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0650 -2.1821 1.0676 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2647 -3.9406 -1.4496 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9538 -2.2018 -1.2435 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3581 0.1094 -0.4715 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7034 1.6298 0.2575 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 1 0 6 7 1 0 7 8 2 0 7 9 2 0 7 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 13 15 1 0 15 16 2 0 5 17 2 0 17 18 1 0 18 19 2 0 19 20 1 0 20 21 2 0 21 22 1 0 22 23 2 0 23 3 1 0 16 10 1 0 22 17 1 0 1 24 1 0 1 25 1 0 1 26 1 0 4 27 1 0 6 28 1 0 11 29 1 0 12 30 1 0 14 31 1 0 14 32 1 0 14 33 1 0 15 34 1 0 16 35 1 0 19 36 1 0 20 37 1 0 21 38 1 0 23 39 1 0 M END