4-[(E)-3-oxidanylidene-3-(4-thiophen-2-ylcarbonylpiperazin-1-yl)prop-1-enyl]benzenecarbonitrile

Systemtic Name: 4-[(E)-3-oxidanylidene-3-(4-thiophen-2-ylcarbonylpiperazin-1-yl)prop-1-enyl]benzenecarbonitrile Openeye Name: 4-[(E)-3-oxo-3-[4-(thiophene-2-carbonyl)piperazin-1-yl]prop-1-enyl]benzonitrile CAS Name: 4-[(E)-3-oxo-3-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]prop-1-enyl]benzonitrile IUPAC Name: 4-[(E)-3-oxo-3-[4-(thiophene-2-carbonyl)piperazin-1-yl]prop-1-enyl]benzonitrile Traditional Name: 4-[(E)-3-keto-3-[4-(2-thenoyl)piperazino]prop-1-enyl]benzonitrile Formula: C19H17N3O2S MolecularWeight: 351.42218

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C=CC2=CC=C(C=C2)C#N)C(=O)C3=CC=CS3

Isomeric SMILES

C1CN(CCN1C(=O)/C=C/C2=CC=C(C=C2)C#N)C(=O)C3=CC=CS3

InChI

InChI=1S/C19H17N3O2S/c20-14-16-5-3-15(4-6-16)7-8-18(23)21-9-11-22(12-10-21)19(24)17-2-1-13-25-17/h1-8,13H,9-12H2/b8-7+