Bapp-trimethoprim

Molecular Formula: C21H23Br2N5O4


InChI: InChI=1/C21H22BrN5O4.BrH/c1-29-16-8-12(7-13-11-25-21(24)27-20(13)23)9-17(30-2)19(16)31-15-5-3-14(4-6-15)26-18(28)10-22;/h3-6,8-9,11H,7,10H2,1-2H3,(H,26,28)(H4,23,24,25,27);1H/f/h26H,23-24H2;

InChIKey: InChIKey=LSKHELMGYVZMCN-VATSBOPBCY
SMILES: COC1=CC(=CC(=C1OC2=CC=C(C=C2)NC(=O)CBr)OC)CC3=CN=C(N=C3N)N.Br

Names:
    Acetamide, 2-bromo-N-(4-(4-((2,4-diamino-5-pyrimidinyl)methyl)-2,6-dimethoxyphenoxy)phenyl)-, monohydrobromide
    Bapp-trimethoprim
    2,4-Diamino-5-((3,5-dimethoxy-4-(4-bromoacetamidophenoxy)benzyl)pyrimidine)
    2-bromo-N-[4-[4-[(2,4-diaminopyrimidin-5-yl)methyl]-2,6-dimethoxy-phenoxy]phenyl]acetamide hydrobromide
    78025-83-9

Registries:
    PubChem CID 64941
    PubChem ID 206874