8-azanyl-1-(4-propylsulfonylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide

Systemtic Name: 8-azanyl-1-(4-propylsulfonylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide Openeye Name: 8-amino-1-(4-propylsulfonylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide CAS Name: 8-amino-1-(4-propylsulfonylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide IUPAC Name: 8-amino-1-(4-propylsulfonylphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide Traditional Name: 8-amino-1-(4-propylsulfonylphenyl)-4,5-dihydrobenz[g]indazole-3-carboxamide Formula: C21H22N4O3S MolecularWeight: 410.48938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)C1=CC=C(C=C1)N2C3=C(CCC4=C3C=C(C=C4)N)C(=N2)C(=O)N

Isomeric SMILES

CCCS(=O)(=O)C1=CC=C(C=C1)N2C3=C(CCC4=C3C=C(C=C4)N)C(=N2)C(=O)N

InChI

InChI=1S/C21H22N4O3S/c1-2-11-29(27,28)16-8-6-15(7-9-16)25-20-17(19(24-25)21(23)26)10-4-13-3-5-14(22)12-18(13)20/h3,5-9,12H,2,4,10-11,22H2,1H3,(H2,23,26)