N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide Openeye Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]benzamide CAS Name: 3-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]benzamide IUPAC Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)benzamide Traditional Name: 3-[(4-besylpiperazino)methyl]-N-(4-methoxy-3-piperidinosulfonyl-phenyl)benzamide Formula: C30H36N4O6S2 MolecularWeight: 612.76004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)S(=O)(=O)N5CCCCC5

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)C2=CC(=CC=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)S(=O)(=O)N5CCCCC5

InChI

InChI=1S/C30H36N4O6S2/c1-40-28-14-13-26(22-29(28)42(38,39)33-15-6-3-7-16-33)31-30(35)25-10-8-9-24(21-25)23-32-17-19-34(20-18-32)41(36,37)27-11-4-2-5-12-27/h2,4-5,8-14,21-22H,3,6-7,15-20,23H2,1H3,(H,31,35)