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2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-6-methyl-benzoic acid

2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-6-methyl-benzoic acid

Systemtic Name:2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-6-methyl-benzoic acid
Openeye Name:2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-6-methyl-benzoic acid
CAS Name:2-[(4,6-dimethoxy-2-pyrimidinyl)thio]-6-methylbenzoic acid
IUPAC Name:2-(4,6-dimethoxypyrimidin-2-yl)sulfanyl-6-methylbenzoic acid
Traditional Name:2-[(4,6-dimethoxypyrimidin-2-yl)thio]-6-methyl-benzoic acid
Formula: C14H14N2O4S
MolecularWeight: 306.33696
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)SC2=NC(=CC(=N2)OC)OC)C(=O)O


Isomeric SMILES

CC1=C(C(=CC=C1)SC2=NC(=CC(=N2)OC)OC)C(=O)O


InChI

InChI=1S/C14H14N2O4S/c1-8-5-4-6-9(12(8)13(17)18)21-14-15-10(19-2)7-11(16-14)20-3/h4-7H,1-3H3,(H,17,18)


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