2-ethanoylsulfanylethyl 3-(but-3-enylcarbamoylamino)propanoate

Systemtic Name: 2-ethanoylsulfanylethyl 3-(but-3-enylcarbamoylamino)propanoate Openeye Name: 2-acetylsulfanylethyl 3-(but-3-enylcarbamoylamino)propanoate CAS Name: 3-[[(but-3-enylamino)-oxomethyl]amino]propanoic acid 2-(acetylthio)ethyl ester IUPAC Name: 2-acetylsulfanylethyl 3-(but-3-enylcarbamoylamino)propanoate Traditional Name: 3-(but-3-enylcarbamoylamino)propionic acid 2-(acetylthio)ethyl ester Formula: C12H20N2O4S MolecularWeight: 288.3632

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCOC(=O)CCNC(=O)NCCC=C

Isomeric SMILES

CC(=O)SCCOC(=O)CCNC(=O)NCCC=C

InChI

InChI=1S/C12H20N2O4S/c1-3-4-6-13-12(17)14-7-5-11(16)18-8-9-19-10(2)15/h3H,1,4-9H2,2H3,(H2,13,14,17)