methyl 2-[(6-bromanyl-2-phenyl-quinazolin-4-yl)amino]benzoate

Systemtic Name: methyl 2-[(6-bromanyl-2-phenyl-quinazolin-4-yl)amino]benzoate Openeye Name: methyl 2-[(6-bromo-2-phenyl-quinazolin-4-yl)amino]benzoate CAS Name: 2-[(6-bromo-2-phenyl-4-quinazolinyl)amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(6-bromo-2-phenylquinazolin-4-yl)amino]benzoate Traditional Name: 2-[(6-bromo-2-phenyl-quinazolin-4-yl)amino]benzoic acid methyl ester Formula: C22H16BrN3O2 MolecularWeight: 434.28534

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC2=NC(=NC3=C2C=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC2=NC(=NC3=C2C=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C22H16BrN3O2/c1-28-22(27)16-9-5-6-10-18(16)25-21-17-13-15(23)11-12-19(17)24-20(26-21)14-7-3-2-4-8-14/h2-13H,1H3,(H,24,25,26)