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

Systemtic Name: (2-fluorophenyl) 5-chloranyl-2-[(4-methylphenyl)methylsulfanyl]pyrimidine-4-carboxylate Openeye Name: (2-fluorophenyl) 5-chloro-2-(p-tolylmethylsulfanyl)pyrimidine-4-carboxylate CAS Name: 5-chloro-2-[(4-methylphenyl)methylthio]-4-pyrimidinecarboxylic acid (2-fluorophenyl) ester IUPAC Name: (2-fluorophenyl) 5-chloro-2-[(4-methylphenyl)methylsulfanyl]pyrimidine-4-carboxylate Traditional Name: 5-chloro-2-[(4-methylbenzyl)thio]pyrimidine-4-carboxylic acid (2-fluorophenyl) ester Formula: C19H14ClFN2O2S MolecularWeight: 388.843063

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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=C3F)Cl

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC=C(C(=N2)C(=O)OC3=CC=CC=C3F)Cl

InChI

InChI=1S/C19H14ClFN2O2S/c1-12-6-8-13(9-7-12)11-26-19-22-10-14(20)17(23-19)18(24)25-16-5-3-2-4-15(16)21/h2-10H,11H2,1H3