[2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[(4-chlorophenyl)sulfonylamino]benzoate

Systemtic Name: [2-(3-methylbutylcarbamoylamino)-2-oxidanylidene-ethyl] 2-[(4-chlorophenyl)sulfonylamino]benzoate Openeye Name: [2-(isopentylcarbamoylamino)-2-oxo-ethyl] 2-[(4-chlorophenyl)sulfonylamino]benzoate CAS Name: 2-[(4-chlorophenyl)sulfonylamino]benzoic acid [2-[[(3-methylbutylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutylcarbamoylamino)-2-oxoethyl] 2-[(4-chlorophenyl)sulfonylamino]benzoate Traditional Name: 2-[(4-chlorophenyl)sulfonylamino]benzoic acid [2-(isoamylcarbamoylamino)-2-keto-ethyl] ester Formula: C21H24ClN3O6S MolecularWeight: 481.94976

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)COC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)COC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H24ClN3O6S/c1-14(2)11-12-23-21(28)24-19(26)13-31-20(27)17-5-3-4-6-18(17)25-32(29,30)16-9-7-15(22)8-10-16/h3-10,14,25H,11-13H2,1-2H3,(H2,23,24,26,28)