4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]-N-[1-(4-piperidin-1-ylphenyl)ethyl]benzamide

Systemtic Name: 4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]-N-[1-(4-piperidin-1-ylphenyl)ethyl]benzamide Openeye Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-[1-[4-(1-piperidyl)phenyl]ethyl]benzamide CAS Name: 4-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-[1-[4-(1-piperidinyl)phenyl]ethyl]benzamide IUPAC Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-[1-(4-piperidin-1-ylphenyl)ethyl]benzamide Traditional Name: 4-[(4-besylpiperazino)methyl]-N-[1-(4-piperidinophenyl)ethyl]benzamide Formula: C31H38N4O3S MolecularWeight: 546.72342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2CCCCC2)NC(=O)C3=CC=C(C=C3)CN4CCN(CC4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC(C1=CC=C(C=C1)N2CCCCC2)NC(=O)C3=CC=C(C=C3)CN4CCN(CC4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C31H38N4O3S/c1-25(27-14-16-29(17-15-27)34-18-6-3-7-19-34)32-31(36)28-12-10-26(11-13-28)24-33-20-22-35(23-21-33)39(37,38)30-8-4-2-5-9-30/h2,4-5,8-17,25H,3,6-7,18-24H2,1H3,(H,32,36)