3-(4-ethylphenyl)-4-[2-(3-nitrophenyl)-2-oxo-ethyl]sulfanyl-3,5,7,8-tetrazabicyclo[4.3.0]nona-4,8,10-trien-2-one

Molecular Formula: C21H17N5O4S


InChI: InChI=1/C21H17N5O4S/c1-2-13-6-8-15(9-7-13)25-20(28)17-11-22-24-19(17)23-21(25)31-12-18(27)14-4-3-5-16(10-14)26(29)30/h3-11H,2,12H2,1H3,(H,22,24)/f/h24H

InChIKey: InChIKey=MHCHZIASOIYZBQ-LQFNOIFHCT
SMILES: CCC1=CC=C(C=C1)N2C(=O)C3=C(NN=C3)N=C2SCC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Names:
    3-(4-ethylphenyl)-4-[2-(3-nitrophenyl)-2-oxo-ethyl]sulfanyl-3,5,7,8-tetrazabicyclo[4.3.0]nona-4,8,10-trien-2-one

Registries:
    PubChem CID 3542366
    PubChem ID 4785539