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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)CC(=O)NC3=CC(=CC=C3)S(=O)(=O)C

InChI

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