N-[5-[[4-[[4-(8-azaspiro[4.4]nonan-8-yl)phenyl]carbonylsulfamoyl]-2-nitro-phenyl]amino]-6-phenylsulfanyl-hexyl]carbamate

Systemtic Name: N-[5-[[4-[[4-(8-azaspiro[4.4]nonan-8-yl)phenyl]carbonylsulfamoyl]-2-nitro-phenyl]amino]-6-phenylsulfanyl-hexyl]carbamate Openeye Name: N-[5-[4-[[4-(8-azaspiro[4.4]nonan-8-yl)benzoyl]sulfamoyl]-2-nitro-anilino]-6-phenylsulfanyl-hexyl]carbamate CAS Name: N-[5-[4-[[[4-(8-azaspiro[4.4]nonan-8-yl)phenyl]-oxomethyl]sulfamoyl]-2-nitroanilino]-6-(phenylthio)hexyl]carbamate IUPAC Name: N-[5-[4-[[4-(8-azaspiro[4.4]nonan-8-yl)benzoyl]sulfamoyl]-2-nitroanilino]-6-phenylsulfanylhexyl]carbamate Traditional Name: N-[5-[4-[[4-(8-azaspiro[4.4]nonan-8-yl)benzoyl]sulfamoyl]-2-nitro-anilino]-6-(phenylthio)hexyl]carbamate Formula: C34H40N5O7S2- MolecularWeight: 694.8407

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(C1)CCN(C2)C3=CC=C(C=C3)C(=O)NS(=O)(=O)C4=CC(=C(C=C4)NC(CCCCNC(=O)[O-])CSC5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCC2(C1)CCN(C2)C3=CC=C(C=C3)C(=O)NS(=O)(=O)C4=CC(=C(C=C4)NC(CCCCNC(=O)[O-])CSC5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C34H41N5O7S2/c40-32(25-11-13-27(14-12-25)38-21-19-34(24-38)17-5-6-18-34)37-48(45,46)29-15-16-30(31(22-29)39(43)44)36-26(8-4-7-20-35-33(41)42)23-47-28-9-2-1-3-10-28/h1-3,9-16,22,26,35-36H,4-8,17-21,23-24H2,(H,37,40)(H,41,42)/p-1