5-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanylmethyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanylmethyl]thiophene-2-carboxylic acid Openeye Name: 5-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanylmethyl]thiophene-2-carboxylic acid CAS Name: 5-[[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]methyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanylmethyl]thiophene-2-carboxylic acid Traditional Name: 5-[[(4-keto-6-methyl-1H-pyrimidin-2-yl)thio]methyl]-2-thenoic acid Formula: C11H10N2O3S2 MolecularWeight: 282.3387

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCC2=CC=C(S2)C(=O)O

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCC2=CC=C(S2)C(=O)O

InChI

InChI=1S/C11H10N2O3S2/c1-6-4-9(14)13-11(12-6)17-5-7-2-3-8(18-7)10(15)16/h2-4H,5H2,1H3,(H,15,16)(H,12,13,14)