[(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl] 3-(diethylsulfamoyl)-4-methyl-benzoate

Systemtic Name: [(2S)-1-oxidanylidene-1-phenylazanyl-propan-2-yl] 3-(diethylsulfamoyl)-4-methyl-benzoate Openeye Name: [(1S)-2-anilino-1-methyl-2-oxo-ethyl] 3-(diethylsulfamoyl)-4-methyl-benzoate CAS Name: 3-(diethylsulfamoyl)-4-methylbenzoic acid [(2S)-1-anilino-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-anilino-1-oxopropan-2-yl] 3-(diethylsulfamoyl)-4-methylbenzoate Traditional Name: 3-(diethylsulfamoyl)-4-methyl-benzoic acid [(1S)-2-anilino-2-keto-1-methyl-ethyl] ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)OC(C)C(=O)NC2=CC=CC=C2)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)C(=O)O[C@@H](C)C(=O)NC2=CC=CC=C2)C

InChI

InChI=1S/C21H26N2O5S/c1-5-23(6-2)29(26,27)19-14-17(13-12-15(19)3)21(25)28-16(4)20(24)22-18-10-8-7-9-11-18/h7-14,16H,5-6H2,1-4H3,(H,22,24)/t16-/m0/s1