6-(4-cyanophenyl)-4-oxidanylidene-2-sulfanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-(4-cyanophenyl)-4-oxidanylidene-2-sulfanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 6-(4-cyanophenyl)-4-oxo-2-thioxo-1H-pyrimidine-5-carbonitrile CAS Name: 6-(4-cyanophenyl)-4-oxo-2-sulfanylidene-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-(4-cyanophenyl)-4-oxo-2-sulfanylidene-1H-pyrimidine-5-carbonitrile Traditional Name: 6-(4-cyanophenyl)-4-keto-2-thioxo-1H-pyrimidine-5-carbonitrile Formula: C12H6N4OS MolecularWeight: 254.26724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C2=C(C(=O)NC(=S)N2)C#N

Isomeric SMILES

C1=CC(=CC=C1C#N)C2=C(C(=O)NC(=S)N2)C#N

InChI

InChI=1S/C12H6N4OS/c13-5-7-1-3-8(4-2-7)10-9(6-14)11(17)16-12(18)15-10/h1-4H,(H2,15,16,17,18)