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

Systemtic Name: (2-chlorophenyl) 5-chloranyl-2-[(4-fluorophenyl)methylsulfanyl]pyrimidine-4-carboxylate Openeye Name: (2-chlorophenyl) 5-chloro-2-[(4-fluorophenyl)methylsulfanyl]pyrimidine-4-carboxylate CAS Name: 5-chloro-2-[(4-fluorophenyl)methylthio]-4-pyrimidinecarboxylic acid (2-chlorophenyl) ester IUPAC Name: (2-chlorophenyl) 5-chloro-2-[(4-fluorophenyl)methylsulfanyl]pyrimidine-4-carboxylate Traditional Name: 5-chloro-2-[(4-fluorobenzyl)thio]pyrimidine-4-carboxylic acid (2-chlorophenyl) ester Formula: C18H11Cl2FN2O2S MolecularWeight: 409.261543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OC(=O)C2=NC(=NC=C2Cl)SCC3=CC=C(C=C3)F)Cl

Isomeric SMILES

C1=CC=C(C(=C1)OC(=O)C2=NC(=NC=C2Cl)SCC3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C18H11Cl2FN2O2S/c19-13-3-1-2-4-15(13)25-17(24)16-14(20)9-22-18(23-16)26-10-11-5-7-12(21)8-6-11/h1-9H,10H2