2-ethanoylsulfanylethyl 3-(2-phenoxyethylcarbamoylamino)propanoate

Systemtic Name: 2-ethanoylsulfanylethyl 3-(2-phenoxyethylcarbamoylamino)propanoate Openeye Name: 2-acetylsulfanylethyl 3-(2-phenoxyethylcarbamoylamino)propanoate CAS Name: 3-[[oxo-(2-phenoxyethylamino)methyl]amino]propanoic acid 2-(acetylthio)ethyl ester IUPAC Name: 2-acetylsulfanylethyl 3-(2-phenoxyethylcarbamoylamino)propanoate Traditional Name: 3-(2-phenoxyethylcarbamoylamino)propionic acid 2-(acetylthio)ethyl ester Formula: C16H22N2O5S MolecularWeight: 354.42128

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCOC(=O)CCNC(=O)NCCOC1=CC=CC=C1

Isomeric SMILES

CC(=O)SCCOC(=O)CCNC(=O)NCCOC1=CC=CC=C1

InChI

InChI=1S/C16H22N2O5S/c1-13(19)24-12-11-23-15(20)7-8-17-16(21)18-9-10-22-14-5-3-2-4-6-14/h2-6H,7-12H2,1H3,(H2,17,18,21)