butyl 2-oxidanylidene-4-sulfanylidene-1H-pyrimidine-6-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=S)NC(=O)N1

Isomeric SMILES

CCCCOC(=O)C1=CC(=S)NC(=O)N1

InChI

InChI=1S/C9H12N2O3S/c1-2-3-4-14-8(12)6-5-7(15)11-9(13)10-6/h5H,2-4H2,1H3,(H2,10,11,13,15)