[2-(diethylamino)-2-oxidanylidene-ethyl] 2-[2-[(4-methylphenyl)sulfonylamino]ethanoylamino]ethanoate

Systemtic Name: [2-(diethylamino)-2-oxidanylidene-ethyl] 2-[2-[(4-methylphenyl)sulfonylamino]ethanoylamino]ethanoate Openeye Name: [2-(diethylamino)-2-oxo-ethyl] 2-[[2-(p-tolylsulfonylamino)acetyl]amino]acetate CAS Name: 2-[[2-[(4-methylphenyl)sulfonylamino]-1-oxoethyl]amino]acetic acid [2-(diethylamino)-2-oxoethyl] ester IUPAC Name: [2-(diethylamino)-2-oxoethyl] 2-[[2-[(4-methylphenyl)sulfonylamino]acetyl]amino]acetate Traditional Name: 2-[[2-(tosylamino)acetyl]amino]acetic acid [2-(diethylamino)-2-keto-ethyl] ester Formula: C17H25N3O6S MolecularWeight: 399.4619

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)COC(=O)CNC(=O)CNS(=O)(=O)C1=CC=C(C=C1)C

Isomeric SMILES

CCN(CC)C(=O)COC(=O)CNC(=O)CNS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C17H25N3O6S/c1-4-20(5-2)16(22)12-26-17(23)11-18-15(21)10-19-27(24,25)14-8-6-13(3)7-9-14/h6-9,19H,4-5,10-12H2,1-3H3,(H,18,21)