8-[(5-fluoranyl-2-nitro-phenyl)carbonylamino]-1-(4-methylsulfonylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide

Systemtic Name: 8-[(5-fluoranyl-2-nitro-phenyl)carbonylamino]-1-(4-methylsulfonylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide Openeye Name: 8-[(5-fluoro-2-nitro-benzoyl)amino]-1-(4-methylsulfonylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide CAS Name: 8-[[(5-fluoro-2-nitrophenyl)-oxomethyl]amino]-1-(4-methylsulfonylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide IUPAC Name: 8-[(5-fluoro-2-nitrobenzoyl)amino]-1-(4-methylsulfonylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide Traditional Name: 8-[(5-fluoro-2-nitro-benzoyl)amino]-1-(4-mesylphenyl)-4,5-dihydrobenz[g]indazole-3-carboxamide Formula: C26H20FN5O6S MolecularWeight: 549.530303

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)N2C3=C(CCC4=C3C=C(C=C4)NC(=O)C5=C(C=CC(=C5)F)[N+](=O)[O-])C(=N2)C(=O)N

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N2C3=C(CCC4=C3C=C(C=C4)NC(=O)C5=C(C=CC(=C5)F)[N+](=O)[O-])C(=N2)C(=O)N

InChI

InChI=1S/C26H20FN5O6S/c1-39(37,38)18-8-6-17(7-9-18)31-24-19(23(30-31)25(28)33)10-3-14-2-5-16(13-20(14)24)29-26(34)21-12-15(27)4-11-22(21)32(35)36/h2,4-9,11-13H,3,10H2,1H3,(H2,28,33)(H,29,34)