cyclopropylmethyl 2-pyridin-2-ylsulfanyl-4-(trifluoromethyl)pyrimidine-5-carboxylate

Systemtic Name: cyclopropylmethyl 2-pyridin-2-ylsulfanyl-4-(trifluoromethyl)pyrimidine-5-carboxylate Openeye Name: cyclopropylmethyl 2-(2-pyridylsulfanyl)-4-(trifluoromethyl)pyrimidine-5-carboxylate CAS Name: 2-(2-pyridinylthio)-4-(trifluoromethyl)-5-pyrimidinecarboxylic acid cyclopropylmethyl ester IUPAC Name: cyclopropylmethyl 2-pyridin-2-ylsulfanyl-4-(trifluoromethyl)pyrimidine-5-carboxylate Traditional Name: 2-(2-pyridylthio)-4-(trifluoromethyl)pyrimidine-5-carboxylic acid cyclopropylmethyl ester Formula: C15H12F3N3O2S MolecularWeight: 355.33489

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1COC(=O)C2=CN=C(N=C2C(F)(F)F)SC3=CC=CC=N3

Isomeric SMILES

C1CC1COC(=O)C2=CN=C(N=C2C(F)(F)F)SC3=CC=CC=N3

InChI

InChI=1S/C15H12F3N3O2S/c16-15(17,18)12-10(13(22)23-8-9-4-5-9)7-20-14(21-12)24-11-3-1-2-6-19-11/h1-3,6-7,9H,4-5,8H2