2-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-N-(3-methylsulfonylphenyl)ethanamide

Systemtic Name: 2-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-N-(3-methylsulfonylphenyl)ethanamide Openeye Name: N-(3-methylsulfonylphenyl)-2-[4-(o-tolylmethyl)piperazin-1-yl]acetamide CAS Name: 2-[4-[(2-methylphenyl)methyl]-1-piperazinyl]-N-(3-methylsulfonylphenyl)acetamide IUPAC Name: 2-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-N-(3-methylsulfonylphenyl)acetamide Traditional Name: N-(3-mesylphenyl)-2-[4-(2-methylbenzyl)piperazino]acetamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)C

InChI

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