cyclopropylmethyl 2-(4-chlorophenyl)sulfanyl-4-(trifluoromethyl)pyrimidine-5-carboxylate

Systemtic Name: cyclopropylmethyl 2-(4-chlorophenyl)sulfanyl-4-(trifluoromethyl)pyrimidine-5-carboxylate Openeye Name: cyclopropylmethyl 2-(4-chlorophenyl)sulfanyl-4-(trifluoromethyl)pyrimidine-5-carboxylate CAS Name: 2-[(4-chlorophenyl)thio]-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid cyclopropylmethyl ester IUPAC Name: cyclopropylmethyl 2-(4-chlorophenyl)sulfanyl-4-(trifluoromethyl)pyrimidine-5-carboxylate Traditional Name: 2-[(4-chlorophenyl)thio]-4-(trifluoromethyl)pyrimidine-5-carboxylic acid cyclopropylmethyl ester Formula: C16H12ClF3N2O2S MolecularWeight: 388.79189

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1COC(=O)C2=CN=C(N=C2C(F)(F)F)SC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CC1COC(=O)C2=CN=C(N=C2C(F)(F)F)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H12ClF3N2O2S/c17-10-3-5-11(6-4-10)25-15-21-7-12(13(22-15)16(18,19)20)14(23)24-8-9-1-2-9/h3-7,9H,1-2,8H2