ethyl 3-[(6-bromanyl-2-phenyl-quinazolin-4-yl)amino]benzoate

Systemtic Name: ethyl 3-[(6-bromanyl-2-phenyl-quinazolin-4-yl)amino]benzoate Openeye Name: ethyl 3-[(6-bromo-2-phenyl-quinazolin-4-yl)amino]benzoate CAS Name: 3-[(6-bromo-2-phenyl-4-quinazolinyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(6-bromo-2-phenylquinazolin-4-yl)amino]benzoate Traditional Name: 3-[(6-bromo-2-phenyl-quinazolin-4-yl)amino]benzoic acid ethyl ester Formula: C23H18BrN3O2 MolecularWeight: 448.31192

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC2=NC(=NC3=C2C=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC2=NC(=NC3=C2C=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C23H18BrN3O2/c1-2-29-23(28)16-9-6-10-18(13-16)25-22-19-14-17(24)11-12-20(19)26-21(27-22)15-7-4-3-5-8-15/h3-14H,2H2,1H3,(H,25,26,27)