1-[2-(5-bromo-2-phenylmethoxy-phenyl)-4-methyl-1,5,7,9-tetrazabicyclo[4.3.0]nona-3,5,7-trien-3-yl]ethanone

Molecular Formula: C21H19BrN4O2


InChI: InChI=1/C21H19BrN4O2/c1-13-19(14(2)27)20(26-21(25-13)23-12-24-26)17-10-16(22)8-9-18(17)28-11-15-6-4-3-5-7-15/h3-10,12,20H,11H2,1-2H3,(H,23,24,25)/f/h24H

InChIKey: InChIKey=KOWNVXHQOFMTIS-LQFNOIFHCI
SMILES: CC1=C(C(N2C(=N1)N=CN2)C3=C(C=CC(=C3)Br)OCC4=CC=CC=C4)C(=O)C

Names:
    1-[2-(5-bromo-2-phenylmethoxy-phenyl)-4-methyl-1,5,7,9-tetrazabicyclo[4.3.0]nona-3,5,7-trien-3-yl]ethanone

Registries:
    PubChem CID 5711895
    PubChem ID 3247535