6-azanyl-4-(3,5-dimethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-2-sulfanylidene-1H-pyrimidine-5-carbonitrile

Systemtic Name: 6-azanyl-4-(3,5-dimethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-2-sulfanylidene-1H-pyrimidine-5-carbonitrile Openeye Name: 6-amino-4-(3,5-dimethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)-2-thioxo-1H-pyrimidine-5-carbonitrile CAS Name: 6-amino-4-(3,5-dimethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)-2-sulfanylidene-1H-pyrimidine-5-carbonitrile IUPAC Name: 6-amino-4-(3,5-dimethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)-2-sulfanylidene-1H-pyrimidine-5-carbonitrile Traditional Name: 6-amino-4-(4-keto-3,5-dimethoxy-cyclohexa-2,5-dien-1-ylidene)-2-thioxo-1H-pyrimidine-5-carbonitrile Formula: C13H12N4O3S MolecularWeight: 304.32438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C(NC(=S)N2)N)C#N)C=C(C1=O)OC

Isomeric SMILES

COC1=CC(=C2C(=C(NC(=S)N2)N)C#N)C=C(C1=O)OC

InChI

InChI=1S/C13H12N4O3S/c1-19-8-3-6(4-9(20-2)11(8)18)10-7(5-14)12(15)17-13(21)16-10/h3-4H,15H2,1-2H3,(H2,16,17,21)