N-(4-bromophenyl)-2-[[9-(3,4-dimethylphenyl)-5-oxo-2,4,8,9-tetrazabicyclo[4.3.0]nona-1,3,6-trien-3-yl]sulfanyl]acetamide

Molecular Formula: C21H18BrN5O2S


InChI: InChI=1/C21H18BrN5O2S/c1-12-3-8-16(9-13(12)2)27-19-17(10-23-27)20(29)26-21(25-19)30-11-18(28)24-15-6-4-14(22)5-7-15/h3-10,23H,11H2,1-2H3,(H,24,28)/f/h24H

InChIKey: InChIKey=WDDJNRAVXZDVOT-LQFNOIFHCT
SMILES: CC1=C(C=C(C=C1)N2C3=NC(=NC(=O)C3=CN2)SCC(=O)NC4=CC=C(C=C4)Br)C

Names:
    N-(4-bromophenyl)-2-[[9-(3,4-dimethylphenyl)-5-oxo-2,4,8,9-tetrazabicyclo[4.3.0]nona-1,3,6-trien-3-yl]sulfanyl]acetamide

Registries:
    PubChem CID 2153260
    PubChem ID 4812396