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

Systemtic Name: 8-[(5-methyl-2-nitro-phenyl)carbonylamino]-1-(4-methylsulfonylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide Openeye Name: 8-[(5-methyl-2-nitro-benzoyl)amino]-1-(4-methylsulfonylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide CAS Name: 8-[[(5-methyl-2-nitrophenyl)-oxomethyl]amino]-1-(4-methylsulfonylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide IUPAC Name: 8-[(5-methyl-2-nitrobenzoyl)amino]-1-(4-methylsulfonylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide Traditional Name: 1-(4-mesylphenyl)-8-[(5-methyl-2-nitro-benzoyl)amino]-4,5-dihydrobenz[g]indazole-3-carboxamide Formula: C27H23N5O6S MolecularWeight: 545.56642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)NC2=CC3=C(CCC4=C3N(N=C4C(=O)N)C5=CC=C(C=C5)S(=O)(=O)C)C=C2

Isomeric SMILES

CC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)NC2=CC3=C(CCC4=C3N(N=C4C(=O)N)C5=CC=C(C=C5)S(=O)(=O)C)C=C2

InChI

InChI=1S/C27H23N5O6S/c1-15-3-12-23(32(35)36)22(13-15)27(34)29-17-6-4-16-5-11-20-24(26(28)33)30-31(25(20)21(16)14-17)18-7-9-19(10-8-18)39(2,37)38/h3-4,6-10,12-14H,5,11H2,1-2H3,(H2,28,33)(H,29,34)