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

Systemtic Name: 4-[(6-methyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanylmethyl]-1,3-thiazole-2-carboxylic acid Openeye Name: 4-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanylmethyl]thiazole-2-carboxylic acid CAS Name: 4-[[(6-methyl-4-oxo-1H-pyrimidin-2-yl)thio]methyl]-2-thiazolecarboxylic acid IUPAC Name: 4-[(6-methyl-4-oxo-1H-pyrimidin-2-yl)sulfanylmethyl]-1,3-thiazole-2-carboxylic acid Traditional Name: 4-[[(4-keto-6-methyl-1H-pyrimidin-2-yl)thio]methyl]thiazole-2-carboxylic acid Formula: C10H9N3O3S2 MolecularWeight: 283.32676

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N=C(N1)SCC2=CSC(=N2)C(=O)O

Isomeric SMILES

CC1=CC(=O)N=C(N1)SCC2=CSC(=N2)C(=O)O

InChI

InChI=1S/C10H9N3O3S2/c1-5-2-7(14)13-10(11-5)18-4-6-3-17-8(12-6)9(15)16/h2-3H,4H2,1H3,(H,15,16)(H,11,13,14)