methyl 2-(2-cyanopropyl)-2,4-dimethyl-4-[(4-sulfamoylcyclohexyl)carbamoyl]hexanoate

Systemtic Name: methyl 2-(2-cyanopropyl)-2,4-dimethyl-4-[(4-sulfamoylcyclohexyl)carbamoyl]hexanoate Openeye Name: methyl 2-(2-cyanopropyl)-2,4-dimethyl-4-[(4-sulfamoylcyclohexyl)carbamoyl]hexanoate CAS Name: 2-(2-cyanopropyl)-2,4-dimethyl-4-[oxo-[(4-sulfamoylcyclohexyl)amino]methyl]hexanoic acid methyl ester IUPAC Name: methyl 2-(2-cyanopropyl)-2,4-dimethyl-4-[(4-sulfamoylcyclohexyl)carbamoyl]hexanoate Traditional Name: 2-(2-cyanopropyl)-2,4-dimethyl-4-[(4-sulfamoylcyclohexyl)carbamoyl]hexanoic acid methyl ester Formula: C20H35N3O5S MolecularWeight: 429.574

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(CC(C)(CC(C)C#N)C(=O)OC)C(=O)NC1CCC(CC1)S(=O)(=O)N

Isomeric SMILES

CCC(C)(CC(C)(CC(C)C#N)C(=O)OC)C(=O)NC1CCC(CC1)S(=O)(=O)N

InChI

InChI=1S/C20H35N3O5S/c1-6-19(3,13-20(4,18(25)28-5)11-14(2)12-21)17(24)23-15-7-9-16(10-8-15)29(22,26)27/h14-16H,6-11,13H2,1-5H3,(H,23,24)(H2,22,26,27)