N-[(2-methylphenyl)-phenyl-methyl]-4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: N-[(2-methylphenyl)-phenyl-methyl]-4-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide Openeye Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-[o-tolyl(phenyl)methyl]benzamide CAS Name: 4-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-[(2-methylphenyl)-phenylmethyl]benzamide IUPAC Name: 4-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-[(2-methylphenyl)-phenylmethyl]benzamide Traditional Name: 4-[(4-besylpiperazino)methyl]-N-[o-tolyl(phenyl)methyl]benzamide Formula: C32H33N3O3S MolecularWeight: 539.68772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)CN4CCN(CC4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC=C1C(C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)CN4CCN(CC4)S(=O)(=O)C5=CC=CC=C5

InChI

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