[(1S)-2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 3-(diethylsulfamoyl)benzoate

Systemtic Name: [(1S)-2-[(3,5-dimethylphenyl)amino]-2-oxidanylidene-1-phenyl-ethyl] 3-(diethylsulfamoyl)benzoate Openeye Name: [(1S)-2-(3,5-dimethylanilino)-2-oxo-1-phenyl-ethyl] 3-(diethylsulfamoyl)benzoate CAS Name: 3-(diethylsulfamoyl)benzoic acid [(1S)-2-(3,5-dimethylanilino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1S)-2-(3,5-dimethylanilino)-2-oxo-1-phenylethyl] 3-(diethylsulfamoyl)benzoate Traditional Name: 3-(diethylsulfamoyl)benzoic acid [(1S)-2-(3,5-dimethylanilino)-2-keto-1-phenyl-ethyl] ester Formula: C27H30N2O5S MolecularWeight: 494.6025

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)OC(C2=CC=CC=C2)C(=O)NC3=CC(=CC(=C3)C)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=CC(=C1)C(=O)O[C@@H](C2=CC=CC=C2)C(=O)NC3=CC(=CC(=C3)C)C

InChI

InChI=1S/C27H30N2O5S/c1-5-29(6-2)35(32,33)24-14-10-13-22(18-24)27(31)34-25(21-11-8-7-9-12-21)26(30)28-23-16-19(3)15-20(4)17-23/h7-18,25H,5-6H2,1-4H3,(H,28,30)/t25-/m0/s1