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

Systemtic Name: 3-(2-oxidanylidene-5-pyridin-2-yl-1-pyridin-3-yl-pyridin-3-yl)thiophene-2-carbonitrile Openeye Name: 3-[2-oxo-5-(2-pyridyl)-1-(3-pyridyl)-3-pyridyl]thiophene-2-carbonitrile CAS Name: 3-[2-oxo-5-(2-pyridinyl)-1-(3-pyridinyl)-3-pyridinyl]-2-thiophenecarbonitrile IUPAC Name: 3-(2-oxo-5-pyridin-2-yl-1-pyridin-3-ylpyridin-3-yl)thiophene-2-carbonitrile Traditional Name: 3-[2-keto-5-(2-pyridyl)-1-(3-pyridyl)-3-pyridyl]thiophene-2-carbonitrile Formula: C20H12N4OS MolecularWeight: 356.40048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=CN(C(=O)C(=C2)C3=C(SC=C3)C#N)C4=CN=CC=C4

Isomeric SMILES

C1=CC=NC(=C1)C2=CN(C(=O)C(=C2)C3=C(SC=C3)C#N)C4=CN=CC=C4

InChI

InChI=1S/C20H12N4OS/c21-11-19-16(6-9-26-19)17-10-14(18-5-1-2-8-23-18)13-24(20(17)25)15-4-3-7-22-12-15/h1-10,12-13H