3-(2-oxidanylidene-1-phenyl-5-pyridin-2-yl-pyridin-3-yl)thiophene-2-carbonitrile

Systemtic Name: 3-(2-oxidanylidene-1-phenyl-5-pyridin-2-yl-pyridin-3-yl)thiophene-2-carbonitrile Openeye Name: 3-[2-oxo-1-phenyl-5-(2-pyridyl)-3-pyridyl]thiophene-2-carbonitrile CAS Name: 3-[2-oxo-1-phenyl-5-(2-pyridinyl)-3-pyridinyl]-2-thiophenecarbonitrile IUPAC Name: 3-(2-oxo-1-phenyl-5-pyridin-2-ylpyridin-3-yl)thiophene-2-carbonitrile Traditional Name: 3-[2-keto-1-phenyl-5-(2-pyridyl)-3-pyridyl]thiophene-2-carbonitrile Formula: C21H13N3OS MolecularWeight: 355.41242

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C=C(C2=O)C3=C(SC=C3)C#N)C4=CC=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C=C(C2=O)C3=C(SC=C3)C#N)C4=CC=CC=N4

InChI

InChI=1S/C21H13N3OS/c22-13-20-17(9-11-26-20)18-12-15(19-8-4-5-10-23-19)14-24(21(18)25)16-6-2-1-3-7-16/h1-12,14H