(2,4-dichlorophenyl) 5-chloranyl-2-[(2-methylphenyl)methylsulfanyl]pyrimidine-4-carboxylate

Systemtic Name: (2,4-dichlorophenyl) 5-chloranyl-2-[(2-methylphenyl)methylsulfanyl]pyrimidine-4-carboxylate Openeye Name: (2,4-dichlorophenyl) 5-chloro-2-(o-tolylmethylsulfanyl)pyrimidine-4-carboxylate CAS Name: 5-chloro-2-[(2-methylphenyl)methylthio]-4-pyrimidinecarboxylic acid (2,4-dichlorophenyl) ester IUPAC Name: (2,4-dichlorophenyl) 5-chloro-2-[(2-methylphenyl)methylsulfanyl]pyrimidine-4-carboxylate Traditional Name: 5-chloro-2-[(2-methylbenzyl)thio]pyrimidine-4-carboxylic acid (2,4-dichlorophenyl) ester Formula: C19H13Cl3N2O2S MolecularWeight: 439.74272

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H13Cl3N2O2S/c1-11-4-2-3-5-12(11)10-27-19-23-9-15(22)17(24-19)18(25)26-16-7-6-13(20)8-14(16)21/h2-9H,10H2,1H3