[2-oxidanylidene-2-(propylcarbamoylamino)ethyl] (2S)-2-[(4-methylphenyl)sulfonylamino]propanoate

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl] (2S)-2-[(4-methylphenyl)sulfonylamino]propanoate Openeye Name: [2-oxo-2-(propylcarbamoylamino)ethyl] (2S)-2-(p-tolylsulfonylamino)propanoate CAS Name: (2S)-2-[(4-methylphenyl)sulfonylamino]propanoic acid [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl] ester IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl] (2S)-2-[(4-methylphenyl)sulfonylamino]propanoate Traditional Name: (2S)-2-(tosylamino)propionic acid [2-keto-2-(propylcarbamoylamino)ethyl] ester Formula: C16H23N3O6S MolecularWeight: 385.43532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCNC(=O)NC(=O)COC(=O)[C@H](C)NS(=O)(=O)C1=CC=C(C=C1)C

InChI

InChI=1S/C16H23N3O6S/c1-4-9-17-16(22)18-14(20)10-25-15(21)12(3)19-26(23,24)13-7-5-11(2)6-8-13/h5-8,12,19H,4,9-10H2,1-3H3,(H2,17,18,20,22)/t12-/m0/s1