(4-methylphenyl)methyl 5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13ClN2O2S/c1-9-3-5-10(6-4-9)8-19-13(18)12-11(15)7-16-14(17-12)20-2/h3-7H,8H2,1-2H3