[2-[[2-[cyclohexyl(methyl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 5-nitrothiophene-2-carboxylate

Systemtic Name: [2-[[2-[cyclohexyl(methyl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 5-nitrothiophene-2-carboxylate Openeye Name: [2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-oxo-ethyl] 5-nitrothiophene-2-carboxylate CAS Name: 5-nitro-2-thiophenecarboxylic acid [2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-oxoethyl] ester IUPAC Name: [2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-oxoethyl] 5-nitrothiophene-2-carboxylate Traditional Name: 5-nitrothiophene-2-carboxylic acid [2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-keto-ethyl] ester Formula: C20H23N3O7S2 MolecularWeight: 481.54252

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)S(=O)(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=CC=C(S3)[N+](=O)[O-]

Isomeric SMILES

CN(C1CCCCC1)S(=O)(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=CC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O7S2/c1-22(14-7-3-2-4-8-14)32(28,29)17-10-6-5-9-15(17)21-18(24)13-30-20(25)16-11-12-19(31-16)23(26)27/h5-6,9-12,14H,2-4,7-8,13H2,1H3,(H,21,24)