[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] (2R)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] (2R)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] (2R)-3-methyl-2-(2-thienylsulfonylamino)butanoate CAS Name: (2R)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] (2R)-3-methyl-2-(thiophen-2-ylsulfonylamino)butanoate Traditional Name: (2R)-3-methyl-2-(2-thienylsulfonylamino)butyric acid [2-keto-2-(propargylamino)ethyl] ester Formula: C14H18N2O5S2 MolecularWeight: 358.43312

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)NCC#C)NS(=O)(=O)C1=CC=CS1

Isomeric SMILES

CC(C)[C@H](C(=O)OCC(=O)NCC#C)NS(=O)(=O)C1=CC=CS1

InChI

InChI=1S/C14H18N2O5S2/c1-4-7-15-11(17)9-21-14(18)13(10(2)3)16-23(19,20)12-6-5-8-22-12/h1,5-6,8,10,13,16H,7,9H2,2-3H3,(H,15,17)/t13-/m1/s1