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

Systemtic Name: N-[(4-methylsulfonylphenyl)methyl]-2-piperazin-2-yl-ethanamide Openeye Name: N-[(4-methylsulfonylphenyl)methyl]-2-piperazin-2-yl-acetamide CAS Name: N-[(4-methylsulfonylphenyl)methyl]-2-(2-piperazinyl)acetamide IUPAC Name: N-[(4-methylsulfonylphenyl)methyl]-2-piperazin-2-ylacetamide Traditional Name: N-(4-mesylbenzyl)-2-piperazin-2-yl-acetamide Formula: C14H21N3O3S MolecularWeight: 311.39984

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CNC(=O)CC2CNCCN2

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CNC(=O)CC2CNCCN2

InChI

InChI=1S/C14H21N3O3S/c1-21(19,20)13-4-2-11(3-5-13)9-17-14(18)8-12-10-15-6-7-16-12/h2-5,12,15-16H,6-10H2,1H3,(H,17,18)