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

Systemtic Name: N-(4-methoxy-3-piperidin-1-ylsulfonyl-phenyl)-4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide Openeye Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-[4-methoxy-3-(1-piperidylsulfonyl)phenyl]benzamide CAS Name: 4-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-[4-methoxy-3-(1-piperidinylsulfonyl)phenyl]benzamide IUPAC Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(4-methoxy-3-piperidin-1-ylsulfonylphenyl)benzamide Traditional Name: 4-[(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=C(C=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=C(C=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4)S(=O)(=O)N5CCCCC5

InChI

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