3-[[4-[[4-(4-fluorophenyl)phenyl]carbonylsulfamoyl]-2-nitro-phenyl]amino]-4-phenylsulfanyl-butanoate

Systemtic Name: 3-[[4-[[4-(4-fluorophenyl)phenyl]carbonylsulfamoyl]-2-nitro-phenyl]amino]-4-phenylsulfanyl-butanoate Openeye Name: 3-[4-[[4-(4-fluorophenyl)benzoyl]sulfamoyl]-2-nitro-anilino]-4-phenylsulfanyl-butanoate CAS Name: 3-[4-[[[4-(4-fluorophenyl)phenyl]-oxomethyl]sulfamoyl]-2-nitroanilino]-4-(phenylthio)butanoate IUPAC Name: 3-[4-[[4-(4-fluorophenyl)benzoyl]sulfamoyl]-2-nitroanilino]-4-phenylsulfanylbutanoate Traditional Name: 3-[4-[[4-(4-fluorophenyl)benzoyl]sulfamoyl]-2-nitro-anilino]-4-(phenylthio)butyrate Formula: C29H23FN3O7S2- MolecularWeight: 608.637223

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCC(CC(=O)[O-])NC2=C(C=C(C=C2)S(=O)(=O)NC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)SCC(CC(=O)[O-])NC2=C(C=C(C=C2)S(=O)(=O)NC(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)F)[N+](=O)[O-]

InChI

InChI=1S/C29H24FN3O7S2/c30-22-12-10-20(11-13-22)19-6-8-21(9-7-19)29(36)32-42(39,40)25-14-15-26(27(17-25)33(37)38)31-23(16-28(34)35)18-41-24-4-2-1-3-5-24/h1-15,17,23,31H,16,18H2,(H,32,36)(H,34,35)/p-1