(4-chloranyl-3-methyl-phenyl) 5-chloranyl-2-[(2-methylphenyl)methylsulfanyl]pyrimidine-4-carboxylate

Systemtic Name: (4-chloranyl-3-methyl-phenyl) 5-chloranyl-2-[(2-methylphenyl)methylsulfanyl]pyrimidine-4-carboxylate Openeye Name: (4-chloro-3-methyl-phenyl) 5-chloro-2-(o-tolylmethylsulfanyl)pyrimidine-4-carboxylate CAS Name: 5-chloro-2-[(2-methylphenyl)methylthio]-4-pyrimidinecarboxylic acid (4-chloro-3-methylphenyl) ester IUPAC Name: (4-chloro-3-methylphenyl) 5-chloro-2-[(2-methylphenyl)methylsulfanyl]pyrimidine-4-carboxylate Traditional Name: 5-chloro-2-[(2-methylbenzyl)thio]pyrimidine-4-carboxylic acid (4-chloro-3-methyl-phenyl) ester Formula: C20H16Cl2N2O2S MolecularWeight: 419.32424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC2=NC=C(C(=N2)C(=O)OC3=CC(=C(C=C3)Cl)C)Cl

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC=C(C(=N2)C(=O)OC3=CC(=C(C=C3)Cl)C)Cl

InChI

InChI=1S/C20H16Cl2N2O2S/c1-12-5-3-4-6-14(12)11-27-20-23-10-17(22)18(24-20)19(25)26-15-7-8-16(21)13(2)9-15/h3-10H,11H2,1-2H3