(2,4,6-trimethylphenyl) 5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxylate

Systemtic Name: (2,4,6-trimethylphenyl) 5-chloranyl-2-methylsulfanyl-pyrimidine-4-carboxylate Openeye Name: (2,4,6-trimethylphenyl) 5-chloro-2-methylsulfanyl-pyrimidine-4-carboxylate CAS Name: 5-chloro-2-(methylthio)-4-pyrimidinecarboxylic acid (2,4,6-trimethylphenyl) ester IUPAC Name: (2,4,6-trimethylphenyl) 5-chloro-2-methylsulfanylpyrimidine-4-carboxylate Traditional Name: 5-chloro-2-(methylthio)pyrimidine-4-carboxylic acid mesityl ester Formula: C15H15ClN2O2S MolecularWeight: 322.8098

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15ClN2O2S/c1-8-5-9(2)13(10(3)6-8)20-14(19)12-11(16)7-17-15(18-12)21-4/h5-7H,1-4H3