butyl 4-[2-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]benzoate

Systemtic Name: butyl 4-[2-(6-bromanyl-4-oxidanylidene-quinazolin-3-yl)ethanoylamino]benzoate Openeye Name: butyl 4-[[2-(6-bromo-4-oxo-quinazolin-3-yl)acetyl]amino]benzoate CAS Name: 4-[[2-(6-bromo-4-oxo-3-quinazolinyl)-1-oxoethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[2-(6-bromo-4-oxoquinazolin-3-yl)acetyl]amino]benzoate Traditional Name: 4-[[2-(6-bromo-4-keto-quinazolin-3-yl)acetyl]amino]benzoic acid butyl ester Formula: C21H20BrN3O4 MolecularWeight: 458.3052

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Br

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)CN2C=NC3=C(C2=O)C=C(C=C3)Br

InChI

InChI=1S/C21H20BrN3O4/c1-2-3-10-29-21(28)14-4-7-16(8-5-14)24-19(26)12-25-13-23-18-9-6-15(22)11-17(18)20(25)27/h4-9,11,13H,2-3,10,12H2,1H3,(H,24,26)