40396719 -OEChem-03282406462D 57 60 0 0 0 0 0 0 0999 V2000 4.5981 -4.0942 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.2731 1.9936 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 6.1807 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 -4.0942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 -4.0942 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.4058 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.0942 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.4058 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6551 1.9936 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.0942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.5942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.5942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.5942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.5942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.0942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -5.0942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -5.5942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.4058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -6.5942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -5.0942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -7.0942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -5.5942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -6.5942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 2.9446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9641 2.9446 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3763 3.7536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7830 4.6672 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3818 3.6491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1953 5.4762 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7940 4.4581 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2008 5.3717 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0197 7.0942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.7842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -1.0116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -1.7019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 -1.7019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 -1.0116 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1215 -2.4866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5200 -3.1768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 -3.1768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 -2.4866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8101 -5.6768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2087 -4.9866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 0.0958 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -6.9042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.4742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -7.7142 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -5.2842 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -6.9042 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3285 3.4462 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3997 4.7320 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1296 3.0827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4474 6.0426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1774 4.3933 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5861 6.8420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2719 7.6606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4533 7.3464 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 4 2 0 0 0 0 1 5 2 0 0 0 0 1 7 1 0 0 0 0 1 16 1 0 0 0 0 2 18 1 0 0 0 0 2 25 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 6 15 2 0 0 0 0 7 13 1 0 0 0 0 7 14 1 0 0 0 0 8 15 1 0 0 0 0 8 18 1 0 0 0 0 8 44 1 0 0 0 0 9 18 2 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 10 33 1 0 0 0 0 11 13 1 0 0 0 0 11 34 1 0 0 0 0 11 35 1 0 0 0 0 12 14 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 19 2 0 0 0 0 17 20 1 0 0 0 0 19 21 1 0 0 0 0 19 45 1 0 0 0 0 20 22 2 0 0 0 0 20 46 1 0 0 0 0 21 23 2 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 23 49 1 0 0 0 0 24 25 2 0 0 0 0 24 26 1 0 0 0 0 25 50 1 0 0 0 0 26 27 2 0 0 0 0 26 28 1 0 0 0 0 27 29 1 0 0 0 0 27 51 1 0 0 0 0 28 30 2 0 0 0 0 28 52 1 0 0 0 0 29 31 2 0 0 0 0 29 53 1 0 0 0 0 30 31 1 0 0 0 0 30 54 1 0 0 0 0 32 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 M END > 40396719 > 1 > 708 > 7 > 1 > 7 > AAADceB7MABgAAAAAAAAAAAAAAAAAWAAAAA8YIAAAAAAAAAB0AAAHgQQQAAADQjF3gSzkZLIEAqsAyVydHDC8KlhCjkJiD04JJiIILKgmRGEIAhokQKIiCcUgIAOEAAAAAAAAAAgAAAAAAAAAAAAAAAAAA== > 1-benzylsulfonyl-N-[4-(4-methylsulfanylphenyl)thiazol-2-yl]piperidine-4-carboxamide > N-[4-[4-(methylthio)phenyl]-2-thiazolyl]-1-(phenylmethyl)sulfonyl-4-piperidinecarboxamide > 1-benzylsulfonyl-N-[4-(4-methylsulfanylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide > 1-benzylsulfonyl-N-[4-(4-methylsulfanylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide > N-[4-(4-methylsulfanylphenyl)-1,3-thiazol-2-yl]-1-(phenylmethyl)sulfonyl-piperidine-4-carboxamide > 1-benzylsulfonyl-N-[4-[4-(methylthio)phenyl]thiazol-2-yl]isonipecotamide > InChI=1S/C23H25N3O3S3/c1-30-20-9-7-18(8-10-20)21-15-31-23(24-21)25-22(27)19-11-13-26(14-12-19)32(28,29)16-17-5-3-2-4-6-17/h2-10,15,19H,11-14,16H2,1H3,(H,24,25,27) > KWCYMNVAUKQOSV-UHFFFAOYSA-N > 3.9 > 487.10580519 > C23H25N3O3S3 > 487.7 > CSC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4 > CSC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3CCN(CC3)S(=O)(=O)CC4=CC=CC=C4 > 141 > 487.10580519 > 0 > 32 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 17 19 8 17 20 8 19 21 8 2 18 8 2 25 8 20 22 8 21 23 8 22 23 8 24 25 8 26 27 8 26 28 8 27 29 8 28 30 8 29 31 8 30 31 8 9 18 8 9 24 8 $$$$