[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 4-methyl-3-[(phenylmethyl)sulfamoyl]benzoate

Systemtic Name: [(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl] 4-methyl-3-[(phenylmethyl)sulfamoyl]benzoate Openeye Name: [(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl] 3-(benzylsulfamoyl)-4-methyl-benzoate CAS Name: 4-methyl-3-[(phenylmethyl)sulfamoyl]benzoic acid [(2S)-1-(ethylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylamino)-1-oxopropan-2-yl] 3-(benzylsulfamoyl)-4-methylbenzoate Traditional Name: 3-(benzylsulfamoyl)-4-methyl-benzoic acid [(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl] ester Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)OC(=O)C1=CC(=C(C=C1)C)S(=O)(=O)NCC2=CC=CC=C2

Isomeric SMILES

CCNC(=O)[C@H](C)OC(=O)C1=CC(=C(C=C1)C)S(=O)(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C20H24N2O5S/c1-4-21-19(23)15(3)27-20(24)17-11-10-14(2)18(12-17)28(25,26)22-13-16-8-6-5-7-9-16/h5-12,15,22H,4,13H2,1-3H3,(H,21,23)/t15-/m0/s1