2-(5-azanyl-3-oxidanylidene-1-phenethyl-2H-pyrrol-4-yl)-6-bromanyl-1H-quinazolin-4-one

Systemtic Name: 2-(5-azanyl-3-oxidanylidene-1-phenethyl-2H-pyrrol-4-yl)-6-bromanyl-1H-quinazolin-4-one Openeye Name: 2-(5-amino-3-oxo-1-phenethyl-2H-pyrrol-4-yl)-6-bromo-1H-quinazolin-4-one CAS Name: 2-(5-amino-3-oxo-1-phenethyl-2H-pyrrol-4-yl)-6-bromo-1H-quinazolin-4-one IUPAC Name: 2-(5-amino-3-oxo-1-phenethyl-2H-pyrrol-4-yl)-6-bromo-1H-quinazolin-4-one Traditional Name: 2-(2-amino-4-keto-1-phenethyl-2-pyrrolin-3-yl)-6-bromo-1H-quinazolin-4-one Formula: C20H17BrN4O2 MolecularWeight: 425.27858

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(=C(N1CCC2=CC=CC=C2)N)C3=NC(=O)C4=C(N3)C=CC(=C4)Br

Isomeric SMILES

C1C(=O)C(=C(N1CCC2=CC=CC=C2)N)C3=NC(=O)C4=C(N3)C=CC(=C4)Br

InChI

InChI=1S/C20H17BrN4O2/c21-13-6-7-15-14(10-13)20(27)24-19(23-15)17-16(26)11-25(18(17)22)9-8-12-4-2-1-3-5-12/h1-7,10H,8-9,11,22H2,(H,23,24,27)