N-[3-(3,4-dimethylphenyl)-7,7-dioxo-7λ6-thia-3,4-diazabicyclo[3.3.0]octa-1,4-dien-2-yl]-2-methyl-3-nitro-benzamide
Molecular Formula:
C21H20N4O5S
InChI: InChI=1/C21H20N4O5S/c1-12-7-8-15(9-13(12)2)24-20(17-10-31(29,30)11-18(17)23-24)22-21(26)16-5-4-6-19(14(16)3)25(27)28/h4-9H,10-11H2,1-3H3,(H,22,26)/f/h22H
InChIKey: InChIKey=CTDZMROOLIOEHP-QWOVJGMICG
SMILES: CC1=C(C=C(C=C1)N2C(=C3CS(=O)(=O)CC3=N2)NC(=O)C4=C(C(=CC=C4)[N+](=O)[O-])C)C
Names:
N-[3-(3,4-dimethylphenyl)-7,7-dioxo-7λ6-thia-3,4-diazabicyclo[3.3.0]octa-1,4-dien-2-yl]-2-methyl-3-nitro-benzamide
Registries:
PubChem CID 4450015
PubChem ID 10183401
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