2-[[2,4-bis(ethylamino)-1,3,5,7,8-pentazabicyclo[4.3.0]nona-2,4,6,8-tetraen-9-yl]sulfanyl]-N-[2-nitro-4-(trifluoromethyl)phenyl]acetamide

Molecular Formula: C17H18F3N9O3S


InChI: InChI=1/C17H18F3N9O3S/c1-3-21-13-24-14(22-4-2)28-15(25-13)26-27-16(28)33-8-12(30)23-10-6-5-9(17(18,19)20)7-11(10)29(31)32/h5-7H,3-4,8H2,1-2H3,(H,23,30)(H2,21,22,24,25,26)/f/h21-23H

InChIKey: InChIKey=OGFMPOLCRCYRGO-CMJFTGLXCH
SMILES: CCNC1=NC2=NN=C(N2C(=N1)NCC)SCC(=O)NC3=C(C=C(C=C3)C(F)(F)F)[N+](=O)[O-]

Names:
    2-[[2,4-bis(ethylamino)-1,3,5,7,8-pentazabicyclo[4.3.0]nona-2,4,6,8-tetraen-9-yl]sulfanyl]-N-[2-nitro-4-(trifluoromethyl)phenyl]acetamide

Registries:
    PubChem CID 3639026
    PubChem ID 9823589