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

Systemtic Name: [(2R)-1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 4-methyl-3-[(phenylmethyl)sulfamoyl]benzoate Openeye Name: [(1R)-2-(cyclopropylamino)-1-methyl-2-oxo-ethyl] 3-(benzylsulfamoyl)-4-methyl-benzoate CAS Name: 4-methyl-3-[(phenylmethyl)sulfamoyl]benzoic acid [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(cyclopropylamino)-1-oxopropan-2-yl] 3-(benzylsulfamoyl)-4-methylbenzoate Traditional Name: 3-(benzylsulfamoyl)-4-methyl-benzoic acid [(1R)-2-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H24N2O5S MolecularWeight: 416.49066

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC(C)C(=O)NC2CC2)S(=O)(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O[C@H](C)C(=O)NC2CC2)S(=O)(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H24N2O5S/c1-14-8-9-17(21(25)28-15(2)20(24)23-18-10-11-18)12-19(14)29(26,27)22-13-16-6-4-3-5-7-16/h3-9,12,15,18,22H,10-11,13H2,1-2H3,(H,23,24)/t15-/m1/s1