N-[(2-methylphenyl)methyl]-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide

Systemtic Name: N-[(2-methylphenyl)methyl]-3-[[4-(phenylsulfonyl)piperazin-1-yl]methyl]benzamide Openeye Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-(o-tolylmethyl)benzamide CAS Name: 3-[[4-(benzenesulfonyl)-1-piperazinyl]methyl]-N-[(2-methylphenyl)methyl]benzamide IUPAC Name: 3-[[4-(benzenesulfonyl)piperazin-1-yl]methyl]-N-[(2-methylphenyl)methyl]benzamide Traditional Name: 3-[(4-besylpiperazino)methyl]-N-(2-methylbenzyl)benzamide Formula: C26H29N3O3S MolecularWeight: 463.59176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)C2=CC(=CC=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)C2=CC(=CC=C2)CN3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H29N3O3S/c1-21-8-5-6-10-24(21)19-27-26(30)23-11-7-9-22(18-23)20-28-14-16-29(17-15-28)33(31,32)25-12-3-2-4-13-25/h2-13,18H,14-17,19-20H2,1H3,(H,27,30)