[2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 4-[(2,5-dimethylphenyl)sulfonylamino]benzoate

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] 4-[(2,5-dimethylphenyl)sulfonylamino]benzoate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 4-[(2,5-dimethylphenyl)sulfonylamino]benzoate CAS Name: 4-[(2,5-dimethylphenyl)sulfonylamino]benzoic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] 4-[(2,5-dimethylphenyl)sulfonylamino]benzoate Traditional Name: 4-[(2,5-dimethylphenyl)sulfonylamino]benzoic acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)COC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C)C

Isomeric SMILES

CCCNC(=O)NC(=O)COC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C)C

InChI

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