2-[4-(5-ethanoylthiophen-3-yl)carbonylpiperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-[4-(5-ethanoylthiophen-3-yl)carbonylpiperazin-1-yl]benzenecarbonitrile Openeye Name: 2-[4-(5-acetylthiophene-3-carbonyl)piperazin-1-yl]benzonitrile CAS Name: 2-[4-[(5-acetyl-3-thiophenyl)-oxomethyl]-1-piperazinyl]benzonitrile IUPAC Name: 2-[4-(5-acetylthiophene-3-carbonyl)piperazin-1-yl]benzonitrile Traditional Name: 2-[4-(5-acetylthiophene-3-carbonyl)piperazino]benzonitrile Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CS1)C(=O)N2CCN(CC2)C3=CC=CC=C3C#N

Isomeric SMILES

CC(=O)C1=CC(=CS1)C(=O)N2CCN(CC2)C3=CC=CC=C3C#N

InChI

InChI=1S/C18H17N3O2S/c1-13(22)17-10-15(12-24-17)18(23)21-8-6-20(7-9-21)16-5-3-2-4-14(16)11-19/h2-5,10,12H,6-9H2,1H3