2-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanylmethyl]furan-3-carboxylic acid

Systemtic Name: 2-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanylmethyl]furan-3-carboxylic acid Openeye Name: 2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanylmethyl]furan-3-carboxylic acid CAS Name: 2-[[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]methyl]-3-furancarboxylic acid IUPAC Name: 2-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanylmethyl]furan-3-carboxylic acid Traditional Name: 2-[[(4-keto-6-methyl-1H-pyrimidin-2-yl)thio]methyl]-3-furoic acid Formula: C11H10N2O4S MolecularWeight: 266.2731

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCC2=C(C=CO2)C(=O)O

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCC2=C(C=CO2)C(=O)O

InChI

InChI=1S/C11H10N2O4S/c1-6-4-9(14)13-11(12-6)18-5-8-7(10(15)16)2-3-17-8/h2-4H,5H2,1H3,(H,15,16)(H,12,13,14)