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

Systemtic Name: propyl 3-[(6-bromanyl-2-phenyl-quinazolin-4-yl)amino]benzoate Openeye Name: propyl 3-[(6-bromo-2-phenyl-quinazolin-4-yl)amino]benzoate CAS Name: 3-[(6-bromo-2-phenyl-4-quinazolinyl)amino]benzoic acid propyl ester IUPAC Name: propyl 3-[(6-bromo-2-phenylquinazolin-4-yl)amino]benzoate Traditional Name: 3-[(6-bromo-2-phenyl-quinazolin-4-yl)amino]benzoic acid propyl ester Formula: C24H20BrN3O2 MolecularWeight: 462.3385

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H20BrN3O2/c1-2-13-30-24(29)17-9-6-10-19(14-17)26-23-20-15-18(25)11-12-21(20)27-22(28-23)16-7-4-3-5-8-16/h3-12,14-15H,2,13H2,1H3,(H,26,27,28)