N-[3-(3,4-dimethylphenyl)-7,7-dioxo-7λ6-thia-3,4-diazabicyclo[3.3.0]octa-1,4-dien-2-yl]-4-methyl-3-nitro-benzamide

Molecular Formula: C21H20N4O5S


InChI: InChI=1/C21H20N4O5S/c1-12-5-7-16(8-14(12)3)24-20(17-10-31(29,30)11-18(17)23-24)22-21(26)15-6-4-13(2)19(9-15)25(27)28/h4-9H,10-11H2,1-3H3,(H,22,26)/f/h22H

InChIKey: InChIKey=GCMGTBFMJAJFPM-QWOVJGMICU
SMILES: CC1=C(C=C(C=C1)N2C(=C3CS(=O)(=O)CC3=N2)NC(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-])C

Names:
    N-[3-(3,4-dimethylphenyl)-7,7-dioxo-7λ6-thia-3,4-diazabicyclo[3.3.0]octa-1,4-dien-2-yl]-4-methyl-3-nitro-benzamide

Registries:
    PubChem CID 4190500
    PubChem ID 8380093