N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-3,5-dinitro-benzamide
Molecular Formula:
C21H22N4O5S
InChI: InChI=1/C21H22N4O5S/c1-4-21(2,3)13-5-6-16-17(11-22)20(31-18(16)9-13)23-19(26)12-7-14(24(27)28)10-15(8-12)25(29)30/h7-8,10,13H,4-6,9H2,1-3H3,(H,23,26)/f/h23H
InChIKey: InChIKey=PTDSLOKCHBMNLV-MPIMZMORCP
SMILES: CCC(C)(C)C1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]
Names:
N-[3-cyano-6-(2-methylbutan-2-yl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-3,5-dinitro-benzamide
Registries:
PubChem CID 4460799
PubChem ID 10187151
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