methyl 2-oxidanylidene-5-propyl-4-sulfanylidene-1H-pyrimidine-6-carboxylate

Systemtic Name: methyl 2-oxidanylidene-5-propyl-4-sulfanylidene-1H-pyrimidine-6-carboxylate Openeye Name: methyl 2-oxo-5-propyl-4-thioxo-1H-pyrimidine-6-carboxylate CAS Name: 2-oxo-5-propyl-4-sulfanylidene-1H-pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 2-oxo-5-propyl-4-sulfanylidene-1H-pyrimidine-6-carboxylate Traditional Name: 2-keto-5-propyl-4-thioxo-1H-pyrimidine-6-carboxylic acid methyl ester Formula: C9H12N2O3S MolecularWeight: 228.26818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(NC(=O)NC1=S)C(=O)OC

Isomeric SMILES

CCCC1=C(NC(=O)NC1=S)C(=O)OC

InChI

InChI=1S/C9H12N2O3S/c1-3-4-5-6(8(12)14-2)10-9(13)11-7(5)15/h3-4H2,1-2H3,(H2,10,11,13,15)