8-acetamido-1-(4-azanylsulfanylperoxyphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide

Systemtic Name: 8-acetamido-1-(4-azanylsulfanylperoxyphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide Openeye Name: 8-acetamido-1-(4-aminosulfanylperoxyphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide CAS Name: 8-acetamido-1-[4-(aminothio)dioxyphenyl]-4,5-dihydrobenzo[g]indazole-3-carboxamide IUPAC Name: 8-acetamido-1-(4-aminosulfanylperoxyphenyl)-4,5-dihydrobenzo[g]indazole-3-carboxamide Traditional Name: 8-acetamido-1-[4-(aminothio)peroxyphenyl]-4,5-dihydrobenz[g]indazole-3-carboxamide Formula: C20H19N5O4S MolecularWeight: 425.46096

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N5O4S/c1-11(26)23-13-4-2-12-3-9-16-18(20(21)27)24-25(19(16)17(12)10-13)14-5-7-15(8-6-14)28-29-30-22/h2,4-8,10H,3,9,22H2,1H3,(H2,21,27)(H,23,26)