methyl 4-[2-fluoranyl-3-(trifluoromethyl)phenyl]-6-methyl-2-pyridin-2-yl-1,4-dihydropyrimidine-5-carboxylate

Systemtic Name: methyl 4-[2-fluoranyl-3-(trifluoromethyl)phenyl]-6-methyl-2-pyridin-2-yl-1,4-dihydropyrimidine-5-carboxylate Openeye Name: methyl 4-[2-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-2-(2-pyridyl)-1,4-dihydropyrimidine-5-carboxylate CAS Name: 4-[2-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-2-(2-pyridinyl)-1,4-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl 4-[2-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-2-pyridin-2-yl-1,4-dihydropyrimidine-5-carboxylate Traditional Name: 4-[2-fluoro-3-(trifluoromethyl)phenyl]-6-methyl-2-(2-pyridyl)-1,4-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C19H15F4N3O2 MolecularWeight: 393.334913

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N=C(N1)C2=CC=CC=N2)C3=C(C(=CC=C3)C(F)(F)F)F)C(=O)OC

Isomeric SMILES

CC1=C(C(N=C(N1)C2=CC=CC=N2)C3=C(C(=CC=C3)C(F)(F)F)F)C(=O)OC

InChI

InChI=1S/C19H15F4N3O2/c1-10-14(18(27)28-2)16(26-17(25-10)13-8-3-4-9-24-13)11-6-5-7-12(15(11)20)19(21,22)23/h3-9,16H,1-2H3,(H,25,26)