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

Systemtic Name: N-[(2-methylphenyl)methyl]-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide Openeye Name: 3-[(4-methylsulfonylpiperazin-1-yl)methyl]-N-(o-tolylmethyl)benzamide CAS Name: N-[(2-methylphenyl)methyl]-3-[(4-methylsulfonyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-[(2-methylphenyl)methyl]-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide Traditional Name: 3-[(4-mesylpiperazino)methyl]-N-(2-methylbenzyl)benzamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O3S/c1-17-6-3-4-8-20(17)15-22-21(25)19-9-5-7-18(14-19)16-23-10-12-24(13-11-23)28(2,26)27/h3-9,14H,10-13,15-16H2,1-2H3,(H,22,25)