6-methyl-2-oxidanylidene-4-prop-2-ynylsulfanyl-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 6-methyl-2-oxidanylidene-4-prop-2-ynylsulfanyl-1H-pyrimidine-5-carboxylic acid Openeye Name: 6-methyl-2-oxo-4-prop-2-ynylsulfanyl-1H-pyrimidine-5-carboxylic acid CAS Name: 6-methyl-2-oxo-4-(prop-2-ynylthio)-1H-pyrimidine-5-carboxylic acid IUPAC Name: 6-methyl-2-oxo-4-prop-2-ynylsulfanyl-1H-pyrimidine-5-carboxylic acid Traditional Name: 2-keto-6-methyl-4-(propargylthio)-1H-pyrimidine-5-carboxylic acid Formula: C9H8N2O3S MolecularWeight: 224.23642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1)SCC#C)C(=O)O

Isomeric SMILES

CC1=C(C(=NC(=O)N1)SCC#C)C(=O)O

InChI

InChI=1S/C9H8N2O3S/c1-3-4-15-7-6(8(12)13)5(2)10-9(14)11-7/h1H,4H2,2H3,(H,12,13)(H,10,11,14)