(2,4-dimethylphenyl) 5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxylate

Systemtic Name: (2,4-dimethylphenyl) 5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxylate Openeye Name: (2,4-dimethylphenyl) 5-chloro-2-methylsulfanyl-pyrimidine-4-carboxylate CAS Name: 5-chloro-2-(methylthio)-4-pyrimidinecarboxylic acid (2,4-dimethylphenyl) ester IUPAC Name: (2,4-dimethylphenyl) 5-chloro-2-methylsulfanylpyrimidine-4-carboxylate Traditional Name: 5-chloro-2-(methylthio)pyrimidine-4-carboxylic acid (2,4-dimethylphenyl) ester Formula: C14H13ClN2O2S MolecularWeight: 308.78322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C2=NC(=NC=C2Cl)SC)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C2=NC(=NC=C2Cl)SC)C

InChI

InChI=1S/C14H13ClN2O2S/c1-8-4-5-11(9(2)6-8)19-13(18)12-10(15)7-16-14(17-12)20-3/h4-7H,1-3H3