4-[(E)-3-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-3-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-3-oxidanylidene-prop-1-enyl]benzenecarbonitrile Openeye Name: 4-[(E)-3-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-3-oxo-prop-1-enyl]benzonitrile CAS Name: 4-[(E)-3-[4-(4-methoxyphenyl)sulfonyl-1-piperazinyl]-3-oxoprop-1-enyl]benzonitrile IUPAC Name: 4-[(E)-3-[4-(4-methoxyphenyl)sulfonylpiperazin-1-yl]-3-oxoprop-1-enyl]benzonitrile Traditional Name: 4-[(E)-3-keto-3-[4-(4-methoxyphenyl)sulfonylpiperazino]prop-1-enyl]benzonitrile Formula: C21H21N3O4S MolecularWeight: 411.47414

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C=CC3=CC=C(C=C3)C#N

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)/C=C/C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H21N3O4S/c1-28-19-7-9-20(10-8-19)29(26,27)24-14-12-23(13-15-24)21(25)11-6-17-2-4-18(16-22)5-3-17/h2-11H,12-15H2,1H3/b11-6+