2,4-dimethyl-6-[(3-methyl-1,2-oxazol-5-yl)methylsulfanyl]pyrimidine-5-carboxylic acid

Systemtic Name: 2,4-dimethyl-6-[(3-methyl-1,2-oxazol-5-yl)methylsulfanyl]pyrimidine-5-carboxylic acid Openeye Name: 2,4-dimethyl-6-[(3-methylisoxazol-5-yl)methylsulfanyl]pyrimidine-5-carboxylic acid CAS Name: 2,4-dimethyl-6-[(3-methyl-5-isoxazolyl)methylthio]-5-pyrimidinecarboxylic acid IUPAC Name: 2,4-dimethyl-6-[(3-methyl-1,2-oxazol-5-yl)methylsulfanyl]pyrimidine-5-carboxylic acid Traditional Name: 2,4-dimethyl-6-[(3-methylisoxazol-5-yl)methylthio]pyrimidine-5-carboxylic acid Formula: C12H13N3O3S MolecularWeight: 279.31492

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)CSC2=NC(=NC(=C2C(=O)O)C)C

Isomeric SMILES

CC1=NOC(=C1)CSC2=NC(=NC(=C2C(=O)O)C)C

InChI

InChI=1S/C12H13N3O3S/c1-6-4-9(18-15-6)5-19-11-10(12(16)17)7(2)13-8(3)14-11/h4H,5H2,1-3H3,(H,16,17)