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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

InChI

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