[2-[[2-[cyclohexyl(methyl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 3-cyanobenzoate

Systemtic Name: [2-[[2-[cyclohexyl(methyl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 3-cyanobenzoate Openeye Name: [2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-oxo-ethyl] 3-cyanobenzoate CAS Name: 3-cyanobenzoic acid [2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-oxoethyl] ester IUPAC Name: [2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-oxoethyl] 3-cyanobenzoate Traditional Name: 3-cyanobenzoic acid [2-[2-[cyclohexyl(methyl)sulfamoyl]anilino]-2-keto-ethyl] ester Formula: C23H25N3O5S MolecularWeight: 455.5267

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)S(=O)(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

CN(C1CCCCC1)S(=O)(=O)C2=CC=CC=C2NC(=O)COC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C23H25N3O5S/c1-26(19-10-3-2-4-11-19)32(29,30)21-13-6-5-12-20(21)25-22(27)16-31-23(28)18-9-7-8-17(14-18)15-24/h5-9,12-14,19H,2-4,10-11,16H2,1H3,(H,25,27)