HMDB0248694 RDKit 3D 4-Carbamothioylphenyl 2-(6-methoxynaphthalen-2-yl)propanoate 45 47 0 0 0 0 0 0 0 0999 V2000 -6.4892 -1.2651 2.5325 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2391 -1.8048 1.2482 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1570 -1.3312 0.4895 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9016 -1.8479 -0.7635 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8311 -1.3772 -1.5103 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9910 -0.3890 -1.0392 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9258 0.0812 -1.7793 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0738 1.0674 -1.3286 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0587 1.5408 -2.1608 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0007 2.9969 -2.4815 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3079 1.2592 -1.4147 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0698 2.1973 -1.0967 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6785 -0.0307 -1.0441 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8593 -0.1979 -0.3511 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0228 -0.4071 -1.0477 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2561 -0.5849 -0.4235 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2654 -0.5413 0.9745 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5303 -0.7220 1.6655 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3268 -1.8463 1.3905 N 0 0 0 0 0 0 0 0 0 0 0 0 7.0163 0.3790 2.7536 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1235 -0.3347 1.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9294 -0.1645 1.0287 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3283 1.5872 -0.0719 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3944 1.1220 0.6781 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2411 0.1319 0.2133 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3108 -0.3445 0.9492 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6489 -1.6210 3.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4166 -1.6555 2.9496 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4260 -0.1571 2.5434 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5513 -2.6270 -1.1533 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6220 -1.7760 -2.4949 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7849 -0.3761 -2.7647 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0525 0.9795 -3.1114 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7237 3.1895 -3.3073 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0005 3.3116 -2.8583 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2794 3.6562 -1.6471 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9764 -0.4350 -2.1411 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1707 -0.7496 -0.9755 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9179 -2.7824 1.1664 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3702 -1.8010 1.3966 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1666 -0.3070 2.7653 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9913 0.0028 1.5477 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6638 2.3719 0.3062 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6014 1.5282 1.6721 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4945 0.0740 1.9304 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 2 0 6 7 1 0 7 8 2 0 8 9 1 0 9 10 1 0 9 11 1 0 11 12 2 0 11 13 1 0 13 14 1 0 14 15 2 0 15 16 1 0 16 17 2 0 17 18 1 0 18 19 1 0 18 20 2 0 17 21 1 0 21 22 2 0 8 23 1 0 23 24 2 0 24 25 1 0 25 26 2 0 26 3 1 0 25 6 1 0 22 14 1 0 1 27 1 0 1 28 1 0 1 29 1 0 4 30 1 0 5 31 1 0 7 32 1 0 9 33 1 0 10 34 1 0 10 35 1 0 10 36 1 0 15 37 1 0 16 38 1 0 19 39 1 0 19 40 1 0 21 41 1 0 22 42 1 0 23 43 1 0 24 44 1 0 26 45 1 0 M END