ethyl 4-methyl-2-oxidanylidene-3-(phenylmethyl)-6-[3-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: ethyl 4-methyl-2-oxidanylidene-3-(phenylmethyl)-6-[3-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-benzyl-4-methyl-2-oxo-6-[3-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylate CAS Name: 4-methyl-2-oxo-3-(phenylmethyl)-6-[3-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-benzyl-4-methyl-2-oxo-6-[3-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-benzyl-2-keto-4-methyl-6-[3-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C22H21F3N2O3 MolecularWeight: 418.40895

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC(=CC=C2)C(F)(F)F)CC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC(=CC=C2)C(F)(F)F)CC3=CC=CC=C3)C

InChI

InChI=1S/C22H21F3N2O3/c1-3-30-20(28)18-14(2)27(13-15-8-5-4-6-9-15)21(29)26-19(18)16-10-7-11-17(12-16)22(23,24)25/h4-12,19H,3,13H2,1-2H3,(H,26,29)