2-[(6-methyl-4-oxidanylidene-5-phenoxy-1H-pyrimidin-2-yl)sulfanyl]ethanoic acid

Systemtic Name: 2-[(6-methyl-4-oxidanylidene-5-phenoxy-1H-pyrimidin-2-yl)sulfanyl]ethanoic acid Openeye Name: 2-[(6-methyl-4-oxo-5-phenoxy-1H-pyrimidin-2-yl)sulfanyl]acetic acid CAS Name: 2-[(6-methyl-4-oxo-5-phenoxy-1H-pyrimidin-2-yl)thio]acetic acid IUPAC Name: 2-[(6-methyl-4-oxo-5-phenoxy-1H-pyrimidin-2-yl)sulfanyl]acetic acid Traditional Name: 2-[(4-keto-6-methyl-5-phenoxy-1H-pyrimidin-2-yl)thio]acetic acid Formula: C13H12N2O4S MolecularWeight: 292.31038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N=C(N1)SCC(=O)O)OC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=O)N=C(N1)SCC(=O)O)OC2=CC=CC=C2

InChI

InChI=1S/C13H12N2O4S/c1-8-11(19-9-5-3-2-4-6-9)12(18)15-13(14-8)20-7-10(16)17/h2-6H,7H2,1H3,(H,16,17)(H,14,15,18)