[2-(cyclohexylcarbamoylamino)-2-oxidanylidene-ethyl] 3-[1-(1-adamantyl)ethylsulfamoyl]benzoate

Systemtic Name: [2-(cyclohexylcarbamoylamino)-2-oxidanylidene-ethyl] 3-[1-(1-adamantyl)ethylsulfamoyl]benzoate Openeye Name: [2-(cyclohexylcarbamoylamino)-2-oxo-ethyl] 3-[1-(1-adamantyl)ethylsulfamoyl]benzoate CAS Name: 3-[1-(1-adamantyl)ethylsulfamoyl]benzoic acid [2-[[(cyclohexylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(cyclohexylcarbamoylamino)-2-oxoethyl] 3-[1-(1-adamantyl)ethylsulfamoyl]benzoate Traditional Name: 3-[1-(1-adamantyl)ethylsulfamoyl]benzoic acid [2-(cyclohexylcarbamoylamino)-2-keto-ethyl] ester Formula: C28H39N3O6S MolecularWeight: 545.69076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C12CC3CC(C1)CC(C3)C2)NS(=O)(=O)C4=CC=CC(=C4)C(=O)OCC(=O)NC(=O)NC5CCCCC5

Isomeric SMILES

CC(C12CC3CC(C1)CC(C3)C2)NS(=O)(=O)C4=CC=CC(=C4)C(=O)OCC(=O)NC(=O)NC5CCCCC5

InChI

InChI=1S/C28H39N3O6S/c1-18(28-14-19-10-20(15-28)12-21(11-19)16-28)31-38(35,36)24-9-5-6-22(13-24)26(33)37-17-25(32)30-27(34)29-23-7-3-2-4-8-23/h5-6,9,13,18-21,23,31H,2-4,7-8,10-12,14-17H2,1H3,(H2,29,30,32,34)