5-ethyl-2-ethylsulfanyl-4-oxidanylidene-1H-pyrimidine-6-carboxylic acid

Systemtic Name: 5-ethyl-2-ethylsulfanyl-4-oxidanylidene-1H-pyrimidine-6-carboxylic acid Openeye Name: 5-ethyl-2-ethylsulfanyl-4-oxo-1H-pyrimidine-6-carboxylic acid CAS Name: 5-ethyl-2-(ethylthio)-4-oxo-1H-pyrimidine-6-carboxylic acid IUPAC Name: 5-ethyl-2-ethylsulfanyl-4-oxo-1H-pyrimidine-6-carboxylic acid Traditional Name: 5-ethyl-2-(ethylthio)-4-keto-1H-pyrimidine-6-carboxylic acid Formula: C9H12N2O3S MolecularWeight: 228.26818

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=NC1=O)SCC)C(=O)O

Isomeric SMILES

CCC1=C(NC(=NC1=O)SCC)C(=O)O

InChI

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