3-[4-(2-oxidanylidene-2-thiophen-2-yl-ethyl)piperazin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 3-[4-(2-oxidanylidene-2-thiophen-2-yl-ethyl)piperazin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 3-[4-[2-oxo-2-(2-thienyl)ethyl]piperazine-1-carbonyl]benzonitrile CAS Name: 3-[oxo-[4-(2-oxo-2-thiophen-2-ylethyl)-1-piperazinyl]methyl]benzonitrile IUPAC Name: 3-[4-(2-oxo-2-thiophen-2-ylethyl)piperazine-1-carbonyl]benzonitrile Traditional Name: 3-[4-[2-keto-2-(2-thienyl)ethyl]piperazine-1-carbonyl]benzonitrile Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)C2=CC=CS2)C(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1CN(CCN1CC(=O)C2=CC=CS2)C(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H17N3O2S/c19-12-14-3-1-4-15(11-14)18(23)21-8-6-20(7-9-21)13-16(22)17-5-2-10-24-17/h1-5,10-11H,6-9,13H2