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

Systemtic Name: ethyl 3-methyl-2-oxidanylidene-4-(pyrrolidin-1-ylmethyl)-6-[2-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylate Openeye Name: ethyl 3-methyl-2-oxo-4-(pyrrolidin-1-ylmethyl)-6-[2-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-methyl-2-oxo-4-(1-pyrrolidinylmethyl)-6-[2-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-2-oxo-4-(pyrrolidin-1-ylmethyl)-6-[2-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 2-keto-3-methyl-4-(pyrrolidinomethyl)-6-[2-(trifluoromethyl)phenyl]-1,6-dihydropyrimidine-5-carboxylic acid ethyl ester Formula: C20H24F3N3O3 MolecularWeight: 411.41807

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2C(F)(F)F)C)CN3CCCC3

Isomeric SMILES

CCOC(=O)C1=C(N(C(=O)NC1C2=CC=CC=C2C(F)(F)F)C)CN3CCCC3

InChI

InChI=1S/C20H24F3N3O3/c1-3-29-18(27)16-15(12-26-10-6-7-11-26)25(2)19(28)24-17(16)13-8-4-5-9-14(13)20(21,22)23/h4-5,8-9,17H,3,6-7,10-12H2,1-2H3,(H,24,28)