2-ethanoylsulfanylethyl 3-(2-cyclopropylethylcarbamoylamino)propanoate

Systemtic Name: 2-ethanoylsulfanylethyl 3-(2-cyclopropylethylcarbamoylamino)propanoate Openeye Name: 2-acetylsulfanylethyl 3-(2-cyclopropylethylcarbamoylamino)propanoate CAS Name: 3-[[(2-cyclopropylethylamino)-oxomethyl]amino]propanoic acid 2-(acetylthio)ethyl ester IUPAC Name: 2-acetylsulfanylethyl 3-(2-cyclopropylethylcarbamoylamino)propanoate Traditional Name: 3-(2-cyclopropylethylcarbamoylamino)propionic acid 2-(acetylthio)ethyl ester Formula: C13H22N2O4S MolecularWeight: 302.38978

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCOC(=O)CCNC(=O)NCCC1CC1

Isomeric SMILES

CC(=O)SCCOC(=O)CCNC(=O)NCCC1CC1

InChI

InChI=1S/C13H22N2O4S/c1-10(16)20-9-8-19-12(17)5-7-15-13(18)14-6-4-11-2-3-11/h11H,2-9H2,1H3,(H2,14,15,18)