8-(propanoylamino)-1-(4-sulfamoylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide

Systemtic Name: 8-(propanoylamino)-1-(4-sulfamoylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide Openeye Name: 8-(propanoylamino)-1-(4-sulfamoylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide CAS Name: 8-(1-oxopropylamino)-1-(4-sulfamoylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide IUPAC Name: 8-(propanoylamino)-1-(4-sulfamoylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide Traditional Name: 8-propionamido-1-(4-sulfamoylphenyl)-4,5-dihydrobenz[g]indazole-3-carboxamide Formula: C21H21N5O4S MolecularWeight: 439.48754

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC2=C(CCC3=C2N(N=C3C(=O)N)C4=CC=C(C=C4)S(=O)(=O)N)C=C1

Isomeric SMILES

CCC(=O)NC1=CC2=C(CCC3=C2N(N=C3C(=O)N)C4=CC=C(C=C4)S(=O)(=O)N)C=C1

InChI

InChI=1S/C21H21N5O4S/c1-2-18(27)24-13-5-3-12-4-10-16-19(21(22)28)25-26(20(16)17(12)11-13)14-6-8-15(9-7-14)31(23,29)30/h3,5-9,11H,2,4,10H2,1H3,(H2,22,28)(H,24,27)(H2,23,29,30)