methyl 5-[(6-methyl-2-oxidanylidene-1H-pyrimidin-4-yl)sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[(6-methyl-2-oxidanylidene-1H-pyrimidin-4-yl)sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[(6-methyl-2-oxo-1H-pyrimidin-4-yl)sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[(6-methyl-2-oxo-1H-pyrimidin-4-yl)thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[(6-methyl-2-oxo-1H-pyrimidin-4-yl)sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[(2-keto-6-methyl-1H-pyrimidin-4-yl)thio]methyl]furan-2-carboxylic acid methyl ester Formula: C12H12N2O4S MolecularWeight: 280.29968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=O)N1)SCC2=CC=C(O2)C(=O)OC

Isomeric SMILES

CC1=CC(=NC(=O)N1)SCC2=CC=C(O2)C(=O)OC

InChI

InChI=1S/C12H12N2O4S/c1-7-5-10(14-12(16)13-7)19-6-8-3-4-9(18-8)11(15)17-2/h3-5H,6H2,1-2H3,(H,13,14,16)