4-[2-nitro-4-(trifluoromethyl)phenyl]-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carbothioamide

Molecular Formula: C20H18F6N4O2S


InChI: InChI=1/C20H18F6N4O2S/c21-19(22,23)13-3-1-4-15(11-13)27-18(33)29-8-2-7-28(9-10-29)16-6-5-14(20(24,25)26)12-17(16)30(31)32/h1,3-6,11-12H,2,7-10H2,(H,27,33)/f/h27H

InChIKey: InChIKey=VLXZMFWWIIMKDR-LELJVTLKCY
SMILES: C1CN(CCN(C1)C(=S)NC2=CC=CC(=C2)C(F)(F)F)C3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Names:
    4-[2-nitro-4-(trifluoromethyl)phenyl]-N-[3-(trifluoromethyl)phenyl]-1,4-diazepane-1-carbothioamide

Registries:
    PubChem CID 2795857
    PubChem ID 3251538