methyl 4-[cyclohexyl-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfamoyl]benzoate

Systemtic Name: methyl 4-[cyclohexyl-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfamoyl]benzoate Openeye Name: methyl 4-[[2-(benzylamino)-2-oxo-ethyl]-cyclohexyl-sulfamoyl]benzoate CAS Name: 4-[cyclohexyl-[2-oxo-2-[(phenylmethyl)amino]ethyl]sulfamoyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-(benzylamino)-2-oxoethyl]-cyclohexylsulfamoyl]benzoate Traditional Name: 4-[[2-(benzylamino)-2-keto-ethyl]-cyclohexyl-sulfamoyl]benzoic acid methyl ester Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCC2=CC=CC=C2)C3CCCCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NCC2=CC=CC=C2)C3CCCCC3

InChI

InChI=1S/C23H28N2O5S/c1-30-23(27)19-12-14-21(15-13-19)31(28,29)25(20-10-6-3-7-11-20)17-22(26)24-16-18-8-4-2-5-9-18/h2,4-5,8-9,12-15,20H,3,6-7,10-11,16-17H2,1H3,(H,24,26)