[2-(3-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate

Systemtic Name: [2-(3-methylbutan-2-ylamino)-2-oxidanylidene-ethyl] 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate Openeye Name: [2-(1,2-dimethylpropylamino)-2-oxo-ethyl] 5-(dimethylsulfamoyl)-2-pyrrolidin-1-yl-benzoate CAS Name: 5-(dimethylsulfamoyl)-2-(1-pyrrolidinyl)benzoic acid [2-(3-methylbutan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(3-methylbutan-2-ylamino)-2-oxoethyl] 5-(dimethylsulfamoyl)-2-pyrrolidin-1-ylbenzoate Traditional Name: 5-(dimethylsulfamoyl)-2-pyrrolidino-benzoic acid [2-(1,2-dimethylpropylamino)-2-keto-ethyl] ester Formula: C20H31N3O5S MolecularWeight: 425.54224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)NC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N(C)C)N2CCCC2

Isomeric SMILES

CC(C)C(C)NC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N(C)C)N2CCCC2

InChI

InChI=1S/C20H31N3O5S/c1-14(2)15(3)21-19(24)13-28-20(25)17-12-16(29(26,27)22(4)5)8-9-18(17)23-10-6-7-11-23/h8-9,12,14-15H,6-7,10-11,13H2,1-5H3,(H,21,24)