2-[4-[2-[methyl(phenyl)amino]ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[2-[methyl(phenyl)amino]ethanoyl]piperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[2-(N-methylanilino)acetyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[2-(N-methylanilino)-1-oxoethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[2-(N-methylanilino)acetyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[2-(N-methylanilino)acetyl]piperazino]sulfonylbenzonitrile Formula: C20H22N4O3S MolecularWeight: 398.47868

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C#N)C3=CC=CC=C3

Isomeric SMILES

CN(CC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C#N)C3=CC=CC=C3

InChI

InChI=1S/C20H22N4O3S/c1-22(18-8-3-2-4-9-18)16-20(25)23-11-13-24(14-12-23)28(26,27)19-10-6-5-7-17(19)15-21/h2-10H,11-14,16H2,1H3