2-[5-azanyl-1-(3,4-dimethylphenyl)-3-oxidanylidene-2H-pyrrol-4-yl]-6-bromanyl-1H-quinazolin-4-one

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2CC(=O)C(=C2N)C3=NC(=O)C4=C(N3)C=CC(=C4)Br)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2CC(=O)C(=C2N)C3=NC(=O)C4=C(N3)C=CC(=C4)Br)C

InChI

InChI=1S/C20H17BrN4O2/c1-10-3-5-13(7-11(10)2)25-9-16(26)17(18(25)22)19-23-15-6-4-12(21)8-14(15)20(27)24-19/h3-8H,9,22H2,1-2H3,(H,23,24,27)