ethyl 4-azanyl-2-[(4-methylquinazolin-2-yl)amino]-6-phenyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[(4-methylquinazolin-2-yl)amino]-6-phenyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[(4-methylquinazolin-2-yl)amino]-6-phenyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[(4-methyl-2-quinazolinyl)amino]-6-phenyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[(4-methylquinazolin-2-yl)amino]-6-phenylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[(4-methylquinazolin-2-yl)amino]-6-phenyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C22H20N6O2 MolecularWeight: 400.4332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(N=C1N)NC2=NC3=CC=CC=C3C(=N2)C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(N=C(N=C1N)NC2=NC3=CC=CC=C3C(=N2)C)C4=CC=CC=C4

InChI

InChI=1S/C22H20N6O2/c1-3-30-20(29)17-18(14-9-5-4-6-10-14)26-22(27-19(17)23)28-21-24-13(2)15-11-7-8-12-16(15)25-21/h4-12H,3H2,1-2H3,(H3,23,24,25,26,27,28)