66921364 -OEChem-03282412322D 55 57 0 0 0 0 0 0 0999 V2000 3.3486 -1.6651 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 3.1858 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3486 -1.6651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3486 -1.6651 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3486 -0.6651 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5826 1.9777 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8486 2.2010 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.3486 1.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2147 0.8349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4826 0.8349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2147 -0.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4826 -0.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8486 2.2010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3486 -2.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3486 3.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2147 -3.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4826 -3.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2147 -4.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4826 -4.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3486 -4.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3486 3.0670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8486 3.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3486 4.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8486 3.9330 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3486 4.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3486 -5.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8486 5.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8486 5.6651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8253 0.7273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4267 1.4176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2706 1.4176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 0.7273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4267 -0.7477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8253 -0.0574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 -0.0574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2706 -0.7477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.7657 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6903 2.5883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1586 1.6640 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7516 -2.8551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9457 -2.8551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7516 -4.4751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9457 -4.4751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6586 2.5300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2286 3.9330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4686 3.9330 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0386 5.3360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7286 -5.6651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3486 -6.2851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9686 -5.6651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9563 6.2756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2660 5.8771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8486 5.0451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4686 5.6651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8486 6.2851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 5 1 0 0 0 0 1 14 1 0 0 0 0 2 13 2 0 0 0 0 5 11 1 0 0 0 0 5 12 1 0 0 0 0 6 8 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 13 1 0 0 0 0 7 15 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 9 11 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 12 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 14 16 2 0 0 0 0 14 17 1 0 0 0 0 15 21 2 0 0 0 0 15 22 1 0 0 0 0 16 18 1 0 0 0 0 16 40 1 0 0 0 0 17 19 2 0 0 0 0 17 41 1 0 0 0 0 18 20 2 0 0 0 0 18 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 26 1 0 0 0 0 21 24 1 0 0 0 0 21 44 1 0 0 0 0 22 25 2 0 0 0 0 22 45 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 23 27 1 0 0 0 0 24 46 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 26 50 1 0 0 0 0 27 28 1 0 0 0 0 27 51 1 0 0 0 0 27 52 1 0 0 0 0 28 53 1 0 0 0 0 28 54 1 0 0 0 0 28 55 1 0 0 0 0 M END > 66921364 > 1 > 622 > 5 > 2 > 5 > AAADceB7MABAAAAAAAAAAAAAAAAAAAAAAAA8YIAAAAAAAAABQAAAHgQQQAAADIjB2AQywYLAAAKIAiVSUHDCABAhAgAIiBmIZIgIYDLA0ZGUIAhglADIyAcUgIAOGAAAAAAAAAAwAAAAAAAAAAAAAAAAAA== > 4-amino-N-(4-ethylphenyl)-1-(p-tolylsulfonyl)piperidine-4-carboxamide > 4-amino-N-(4-ethylphenyl)-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide > 4-amino-N-(4-ethylphenyl)-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide > 4-amino-N-(4-ethylphenyl)-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide > 4-azanyl-N-(4-ethylphenyl)-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide > 4-amino-N-(4-ethylphenyl)-1-tosyl-isonipecotamide > InChI=1S/C21H27N3O3S/c1-3-17-6-8-18(9-7-17)23-20(25)21(22)12-14-24(15-13-21)28(26,27)19-10-4-16(2)5-11-19/h4-11H,3,12-15,22H2,1-2H3,(H,23,25) > BDGSACJFUSQCML-UHFFFAOYSA-N > 2.5 > 401.17731291 > C21H27N3O3S > 401.5 > CCC1=CC=C(C=C1)NC(=O)C2(CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C)N > CCC1=CC=C(C=C1)NC(=O)C2(CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C)N > 101 > 401.17731291 > 0 > 28 > 0 > 0 > 0 > 0 > 0 > 1 > -1 > 1 5 255 > 14 16 8 14 17 8 15 21 8 15 22 8 16 18 8 17 19 8 18 20 8 19 20 8 21 24 8 22 25 8 23 24 8 23 25 8 $$$$