ethyl 4-[5-azanyl-4-(6-bromanyl-4-oxidanylidene-1H-quinazolin-2-yl)-3-oxidanylidene-2H-pyrrol-1-yl]benzoate

Systemtic Name: ethyl 4-[5-azanyl-4-(6-bromanyl-4-oxidanylidene-1H-quinazolin-2-yl)-3-oxidanylidene-2H-pyrrol-1-yl]benzoate Openeye Name: ethyl 4-[5-amino-4-(6-bromo-4-oxo-1H-quinazolin-2-yl)-3-oxo-2H-pyrrol-1-yl]benzoate CAS Name: 4-[5-amino-4-(6-bromo-4-oxo-1H-quinazolin-2-yl)-3-oxo-2H-pyrrol-1-yl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[5-amino-4-(6-bromo-4-oxo-1H-quinazolin-2-yl)-3-oxo-2H-pyrrol-1-yl]benzoate Traditional Name: 4-[2-amino-3-(6-bromo-4-keto-1H-quinazolin-2-yl)-4-keto-2-pyrrolin-1-yl]benzoic acid ethyl ester Formula: C21H17BrN4O4 MolecularWeight: 469.28808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2CC(=O)C(=C2N)C3=NC(=O)C4=C(N3)C=CC(=C4)Br

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2CC(=O)C(=C2N)C3=NC(=O)C4=C(N3)C=CC(=C4)Br

InChI

InChI=1S/C21H17BrN4O4/c1-2-30-21(29)11-3-6-13(7-4-11)26-10-16(27)17(18(26)23)19-24-15-8-5-12(22)9-14(15)20(28)25-19/h3-9H,2,10,23H2,1H3,(H,24,25,28)