[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate

Systemtic Name: [2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl] 3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate Openeye Name: [2-(isopropylcarbamoylamino)-2-oxo-ethyl] 3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate CAS Name: 3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoic acid [2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propan-2-ylcarbamoylamino)ethyl] 3-[(2,4,6-trimethylphenyl)sulfonylamino]propanoate Traditional Name: 3-(mesitylsulfonylamino)propionic acid [2-(isopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C18H27N3O6S MolecularWeight: 413.48848

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27N3O6S/c1-11(2)20-18(24)21-15(22)10-27-16(23)6-7-19-28(25,26)17-13(4)8-12(3)9-14(17)5/h8-9,11,19H,6-7,10H2,1-5H3,(H2,20,21,22,24)