2-butylsulfanyl-4-oxidanylidene-1H-pyrimidine-6-carboxylic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=NC(=O)C=C(N1)C(=O)O

Isomeric SMILES

CCCCSC1=NC(=O)C=C(N1)C(=O)O

InChI

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