[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 3-[(2,4-dimethylphenyl)sulfonylamino]propanoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 3-[(2,4-dimethylphenyl)sulfonylamino]propanoate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] 3-[(2,4-dimethylphenyl)sulfonylamino]propanoate CAS Name: 3-[(2,4-dimethylphenyl)sulfonylamino]propanoic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 3-[(2,4-dimethylphenyl)sulfonylamino]propanoate Traditional Name: 3-[(2,4-dimethylphenyl)sulfonylamino]propionic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C17H25N3O6S MolecularWeight: 399.4619

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)NCCC(=O)OCC(=O)NC(=O)NC(C)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)NCCC(=O)OCC(=O)NC(=O)NC(C)C)C

InChI

InChI=1S/C17H25N3O6S/c1-11(2)19-17(23)20-15(21)10-26-16(22)7-8-18-27(24,25)14-6-5-12(3)9-13(14)4/h5-6,9,11,18H,7-8,10H2,1-4H3,(H2,19,20,21,23)