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

Systemtic Name: methyl (4S)-1-ethyl-6-methyl-4-phenyl-2-(2-pyridin-3-ylethylamino)-4H-pyrimidine-5-carboxylate Openeye Name: methyl (4S)-1-ethyl-6-methyl-4-phenyl-2-[2-(3-pyridyl)ethylamino]-4H-pyrimidine-5-carboxylate CAS Name: (4S)-1-ethyl-6-methyl-4-phenyl-2-[2-(3-pyridinyl)ethylamino]-4H-pyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (4S)-1-ethyl-6-methyl-4-phenyl-2-(2-pyridin-3-ylethylamino)-4H-pyrimidine-5-carboxylate Traditional Name: (4S)-1-ethyl-6-methyl-4-phenyl-2-[2-(3-pyridyl)ethylamino]-4H-pyrimidine-5-carboxylic acid methyl ester Formula: C22H26N4O2 MolecularWeight: 378.46744

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(N=C1NCCC2=CN=CC=C2)C3=CC=CC=C3)C(=O)OC)C

Isomeric SMILES

CCN1C(=C([C@@H](N=C1NCCC2=CN=CC=C2)C3=CC=CC=C3)C(=O)OC)C

InChI

InChI=1S/C22H26N4O2/c1-4-26-16(2)19(21(27)28-3)20(18-10-6-5-7-11-18)25-22(26)24-14-12-17-9-8-13-23-15-17/h5-11,13,15,20H,4,12,14H2,1-3H3,(H,24,25)/t20-/m0/s1