N-[(3-methylphenyl)-phenyl-methyl]-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: N-[(3-methylphenyl)-phenyl-methyl]-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide Openeye Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-[m-tolyl(phenyl)methyl]benzamide CAS Name: 3-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-[(3-methylphenyl)-phenylmethyl]benzamide IUPAC Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-[(3-methylphenyl)-phenylmethyl]benzamide Traditional Name: 3-[(4-besylpiperazino)methyl]-N-[m-tolyl(phenyl)methyl]benzamide Formula: C32H33N3O3S MolecularWeight: 539.68772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)C(C2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)CN4CCN(CC4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)C(C2=CC=CC=C2)NC(=O)C3=CC(=CC=C3)CN4CCN(CC4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C32H33N3O3S/c1-25-10-8-14-28(22-25)31(27-12-4-2-5-13-27)33-32(36)29-15-9-11-26(23-29)24-34-18-20-35(21-19-34)39(37,38)30-16-6-3-7-17-30/h2-17,22-23,31H,18-21,24H2,1H3,(H,33,36)