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

Systemtic Name: N-(2-cyanophenyl)-2-[4-(phenylmethyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: 2-(4-benzylsulfonylpiperazin-1-yl)-N-(2-cyanophenyl)acetamide CAS Name: N-(2-cyanophenyl)-2-[4-(phenylmethyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: 2-(4-benzylsulfonylpiperazin-1-yl)-N-(2-cyanophenyl)acetamide Traditional Name: 2-(4-benzylsulfonylpiperazino)-N-(2-cyanophenyl)acetamide Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=CC=CC=C2C#N)S(=O)(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=CC=CC=C2C#N)S(=O)(=O)CC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O3S/c21-14-18-8-4-5-9-19(18)22-20(25)15-23-10-12-24(13-11-23)28(26,27)16-17-6-2-1-3-7-17/h1-9H,10-13,15-16H2,(H,22,25)