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

Systemtic Name: phenyl 5-chloranyl-2-[(4-methylphenyl)methylsulfanyl]pyrimidine-4-carboxylate Openeye Name: phenyl 5-chloro-2-(p-tolylmethylsulfanyl)pyrimidine-4-carboxylate CAS Name: 5-chloro-2-[(4-methylphenyl)methylthio]-4-pyrimidinecarboxylic acid phenyl ester IUPAC Name: phenyl 5-chloro-2-[(4-methylphenyl)methylsulfanyl]pyrimidine-4-carboxylate Traditional Name: 5-chloro-2-[(4-methylbenzyl)thio]pyrimidine-4-carboxylic acid phenyl ester Formula: C19H15ClN2O2S MolecularWeight: 370.8526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC=C(C(=N2)C(=O)OC3=CC=CC=C3)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC=C(C(=N2)C(=O)OC3=CC=CC=C3)Cl

InChI

InChI=1S/C19H15ClN2O2S/c1-13-7-9-14(10-8-13)12-25-19-21-11-16(20)17(22-19)18(23)24-15-5-3-2-4-6-15/h2-11H,12H2,1H3