N-(3-ethylphenyl)-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(3-ethylphenyl)-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: 2-(4-benzylsulfonylpiperazin-1-yl)-N-(3-ethylphenyl)acetamide CAS Name: N-(3-ethylphenyl)-2-[4-(phenylmethyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: 2-(4-benzylsulfonylpiperazin-1-yl)-N-(3-ethylphenyl)acetamide Traditional Name: 2-(4-benzylsulfonylpiperazino)-N-(3-ethylphenyl)acetamide Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

CCC1=CC(=CC=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)CC3=CC=CC=C3

InChI

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