[2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 4-[methyl(phenyl)sulfamoyl]benzoate

Systemtic Name: [2-(butylcarbamoylamino)-2-oxidanylidene-ethyl] 4-[methyl(phenyl)sulfamoyl]benzoate Openeye Name: [2-(butylcarbamoylamino)-2-oxo-ethyl] 4-[methyl(phenyl)sulfamoyl]benzoate CAS Name: 4-[methyl(phenyl)sulfamoyl]benzoic acid [2-[[butylamino(oxo)methyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(butylcarbamoylamino)-2-oxoethyl] 4-[methyl(phenyl)sulfamoyl]benzoate Traditional Name: 4-[methyl(phenyl)sulfamoyl]benzoic acid [2-(butylcarbamoylamino)-2-keto-ethyl] ester Formula: C21H25N3O6S MolecularWeight: 447.5047

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NC(=O)COC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=CC=C2

Isomeric SMILES

CCCCNC(=O)NC(=O)COC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)C2=CC=CC=C2

InChI

InChI=1S/C21H25N3O6S/c1-3-4-14-22-21(27)23-19(25)15-30-20(26)16-10-12-18(13-11-16)31(28,29)24(2)17-8-6-5-7-9-17/h5-13H,3-4,14-15H2,1-2H3,(H2,22,23,25,27)