methyl (4S)-1-ethyl-4-(3-fluorophenyl)-6-methyl-2-(2-pyridin-2-ylethylamino)-4H-pyrimidine-5-carboxylate

Systemtic Name: methyl (4S)-1-ethyl-4-(3-fluorophenyl)-6-methyl-2-(2-pyridin-2-ylethylamino)-4H-pyrimidine-5-carboxylate Openeye Name: methyl (4S)-1-ethyl-4-(3-fluorophenyl)-6-methyl-2-[2-(2-pyridyl)ethylamino]-4H-pyrimidine-5-carboxylate CAS Name: (4S)-1-ethyl-4-(3-fluorophenyl)-6-methyl-2-[2-(2-pyridinyl)ethylamino]-4H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4S)-1-ethyl-4-(3-fluorophenyl)-6-methyl-2-(2-pyridin-2-ylethylamino)-4H-pyrimidine-5-carboxylate Traditional Name: (4S)-1-ethyl-4-(3-fluorophenyl)-6-methyl-2-[2-(2-pyridyl)ethylamino]-4H-pyrimidine-5-carboxylic acid methyl ester Formula: C22H25FN4O2 MolecularWeight: 396.457903

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(N=C1NCCC2=CC=CC=N2)C3=CC(=CC=C3)F)C(=O)OC)C

Isomeric SMILES

CCN1C(=C([C@@H](N=C1NCCC2=CC=CC=N2)C3=CC(=CC=C3)F)C(=O)OC)C

InChI

InChI=1S/C22H25FN4O2/c1-4-27-15(2)19(21(28)29-3)20(16-8-7-9-17(23)14-16)26-22(27)25-13-11-18-10-5-6-12-24-18/h5-10,12,14,20H,4,11,13H2,1-3H3,(H,25,26)/t20-/m0/s1