2-[(2,4-dimethyl-1,5,7,8-tetrazabicyclo[4.3.0]nona-2,4,6,8-tetraen-9-yl)sulfanyl]-N-[2-[(4-fluorophenyl)amino]-5-nitro-phenyl]acetamide

Molecular Formula: C21H18FN7O3S


InChI: InChI=1/C21H18FN7O3S/c1-12-9-13(2)28-20(23-12)26-27-21(28)33-11-19(30)25-18-10-16(29(31)32)7-8-17(18)24-15-5-3-14(22)4-6-15/h3-10,24H,11H2,1-2H3,(H,25,30)/f/h25H

InChIKey: InChIKey=IMKAMEOWOCGQPQ-LNNLXFCOCG
SMILES: CC1=CC(=NC2=NN=C(N12)SCC(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])NC4=CC=C(C=C4)F)C

Names:
    2-[(2,4-dimethyl-1,5,7,8-tetrazabicyclo[4.3.0]nona-2,4,6,8-tetraen-9-yl)sulfanyl]-N-[2-[(4-fluorophenyl)amino]-5-nitro-phenyl]acetamide

Registries:
    PubChem CID 4841334
    PubChem ID 9798884