N-tert-butyl-4-[8-methyl-3-(oxidanylamino)-2-oxidanylidene-7,9-dihydro-6H-pyrrolo[3,2-h]isoquinolin-5-yl]benzenesulfonamide

Systemtic Name: N-tert-butyl-4-[8-methyl-3-(oxidanylamino)-2-oxidanylidene-7,9-dihydro-6H-pyrrolo[3,2-h]isoquinolin-5-yl]benzenesulfonamide Openeye Name: N-tert-butyl-4-[3-(hydroxyamino)-8-methyl-2-oxo-7,9-dihydro-6H-pyrrolo[3,2-h]isoquinolin-5-yl]benzenesulfonamide CAS Name: N-tert-butyl-4-[3-(hydroxyamino)-8-methyl-2-oxo-7,9-dihydro-6H-pyrrolo[3,2-h]isoquinolin-5-yl]benzenesulfonamide IUPAC Name: N-tert-butyl-4-[3-(hydroxyamino)-8-methyl-2-oxo-7,9-dihydro-6H-pyrrolo[3,2-h]isoquinolin-5-yl]benzenesulfonamide Traditional Name: N-tert-butyl-4-[3-(hydroxyamino)-2-keto-8-methyl-7,9-dihydro-6H-pyrrol[3,2-h]isoquinolin-5-yl]benzenesulfonamide Formula: C22H26N4O4S MolecularWeight: 442.53124

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)C2=CC3=C(C(=O)N=C3C4=C2CCN(C4)C)NO

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)C2=CC3=C(C(=O)N=C3C4=C2CCN(C4)C)NO

InChI

InChI=1S/C22H26N4O4S/c1-22(2,3)25-31(29,30)14-7-5-13(6-8-14)16-11-17-19(23-21(27)20(17)24-28)18-12-26(4)10-9-15(16)18/h5-8,11,25,28H,9-10,12H2,1-4H3,(H,23,24,27)