2-[[[2-[1-(4-bromanyl-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl]-methyl-amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-[[[2-[1-(4-bromanyl-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxidanylidene-ethyl]-methyl-amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-[[[2-[1-(4-bromo-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-oxo-ethyl]-methyl-amino]methyl]-1H-quinazolin-4-one CAS Name: 2-[[[2-[1-(4-bromo-3-methylphenyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl]-methylamino]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[[[2-[1-(4-bromo-3-methylphenyl)-2,5-dimethylpyrrol-3-yl]-2-oxoethyl]-methylamino]methyl]-1H-quinazolin-4-one Traditional Name: 2-[[[2-[1-(4-bromo-3-methyl-phenyl)-2,5-dimethyl-pyrrol-3-yl]-2-keto-ethyl]-methyl-amino]methyl]-1H-quinazolin-4-one Formula: C25H25BrN4O2 MolecularWeight: 493.3956

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=C(C=C2)Br)C)C)C(=O)CN(C)CC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=C(C=C2)Br)C)C)C(=O)CN(C)CC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C25H25BrN4O2/c1-15-11-18(9-10-21(15)26)30-16(2)12-20(17(30)3)23(31)13-29(4)14-24-27-22-8-6-5-7-19(22)25(32)28-24/h5-12H,13-14H2,1-4H3,(H,27,28,32)