ethyl 4-[2,3-bis(trifluoromethyloxy)phenyl]-6-methyl-2-pyridin-2-yl-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[2,3-bis(trifluoromethyloxy)phenyl]-6-methyl-2-pyridin-2-yl-1,4-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 4-[2,3-bis(trifluoromethoxy)phenyl]-6-methyl-2-(2-pyridyl)-1,4-dihydropyrimidine-5-carboxylate CAS Name: 4-[2,3-bis(trifluoromethoxy)phenyl]-6-methyl-2-(2-pyridinyl)-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[2,3-bis(trifluoromethoxy)phenyl]-6-methyl-2-pyridin-2-yl-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 4-[2,3-bis(trifluoromethoxy)phenyl]-6-methyl-2-(2-pyridyl)-1,4-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C21H17F6N3O4 MolecularWeight: 489.367799

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=NC1C2=C(C(=CC=C2)OC(F)(F)F)OC(F)(F)F)C3=CC=CC=N3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=NC1C2=C(C(=CC=C2)OC(F)(F)F)OC(F)(F)F)C3=CC=CC=N3)C

InChI

InChI=1S/C21H17F6N3O4/c1-3-32-19(31)15-11(2)29-18(13-8-4-5-10-28-13)30-16(15)12-7-6-9-14(33-20(22,23)24)17(12)34-21(25,26)27/h4-10,16H,3H2,1-2H3,(H,29,30)