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

Systemtic Name: [1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 3-[(4-butylphenyl)sulfamoyl]benzoate Openeye Name: [2-(cyclopropylamino)-1-methyl-2-oxo-ethyl] 3-[(4-butylphenyl)sulfamoyl]benzoate CAS Name: 3-[(4-butylphenyl)sulfamoyl]benzoic acid [1-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclopropylamino)-1-oxopropan-2-yl] 3-[(4-butylphenyl)sulfamoyl]benzoate Traditional Name: 3-[(4-butylphenyl)sulfamoyl]benzoic acid [2-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C23H28N2O5S MolecularWeight: 444.54382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)OC(C)C(=O)NC3CC3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)OC(C)C(=O)NC3CC3

InChI

InChI=1S/C23H28N2O5S/c1-3-4-6-17-9-11-20(12-10-17)25-31(28,29)21-8-5-7-18(15-21)23(27)30-16(2)22(26)24-19-13-14-19/h5,7-12,15-16,19,25H,3-4,6,13-14H2,1-2H3,(H,24,26)