[2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 3-[methyl-(4-methylphenyl)sulfamoyl]benzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-enylcarbamoylamino)ethyl] 3-[methyl-(4-methylphenyl)sulfamoyl]benzoate Openeye Name: [2-(allylcarbamoylamino)-2-oxo-ethyl] 3-[methyl(p-tolyl)sulfamoyl]benzoate CAS Name: 3-[methyl-(4-methylphenyl)sulfamoyl]benzoic acid [2-oxo-2-[[oxo-(prop-2-enylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-enylcarbamoylamino)ethyl] 3-[methyl-(4-methylphenyl)sulfamoyl]benzoate Traditional Name: 3-[methyl(p-tolyl)sulfamoyl]benzoic acid [2-(allylcarbamoylamino)-2-keto-ethyl] ester Formula: C21H23N3O6S MolecularWeight: 445.48882

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC(=O)NC(=O)NCC=C

Isomeric SMILES

CC1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC(=O)NC(=O)NCC=C

InChI

InChI=1S/C21H23N3O6S/c1-4-12-22-21(27)23-19(25)14-30-20(26)16-6-5-7-18(13-16)31(28,29)24(3)17-10-8-15(2)9-11-17/h4-11,13H,1,12,14H2,2-3H3,(H2,22,23,25,27)