4-but-3-ynylsulfanyl-6-methyl-2-oxidanylidene-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 4-but-3-ynylsulfanyl-6-methyl-2-oxidanylidene-1H-pyrimidine-5-carboxylic acid Openeye Name: 4-but-3-ynylsulfanyl-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid CAS Name: 4-(but-3-ynylthio)-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid IUPAC Name: 4-but-3-ynylsulfanyl-6-methyl-2-oxo-1H-pyrimidine-5-carboxylic acid Traditional Name: 4-(but-3-ynylthio)-2-keto-6-methyl-1H-pyrimidine-5-carboxylic acid Formula: C10H10N2O3S MolecularWeight: 238.263

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H10N2O3S/c1-3-4-5-16-8-7(9(13)14)6(2)11-10(15)12-8/h1H,4-5H2,2H3,(H,13,14)(H,11,12,15)