[(2R)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 3-[(4-butylphenyl)sulfamoyl]benzoate

Systemtic Name: [(2R)-1-(methylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 3-[(4-butylphenyl)sulfamoyl]benzoate Openeye Name: [(1R)-1-methyl-2-(methylcarbamoylamino)-2-oxo-ethyl] 3-[(4-butylphenyl)sulfamoyl]benzoate CAS Name: 3-[(4-butylphenyl)sulfamoyl]benzoic acid [(2R)-1-(methylcarbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(methylcarbamoylamino)-1-oxopropan-2-yl] 3-[(4-butylphenyl)sulfamoyl]benzoate Traditional Name: 3-[(4-butylphenyl)sulfamoyl]benzoic acid [(1R)-2-keto-1-methyl-2-(methylcarbamoylamino)ethyl] ester Formula: C22H27N3O6S MolecularWeight: 461.53128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)OC(C)C(=O)NC(=O)NC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)O[C@H](C)C(=O)NC(=O)NC

InChI

InChI=1S/C22H27N3O6S/c1-4-5-7-16-10-12-18(13-11-16)25-32(29,30)19-9-6-8-17(14-19)21(27)31-15(2)20(26)24-22(28)23-3/h6,8-15,25H,4-5,7H2,1-3H3,(H2,23,24,26,28)/t15-/m1/s1