2-ethanoylsulfanylethyl 3-[(phenylmethyl)carbamoylamino]propanoate

Systemtic Name: 2-ethanoylsulfanylethyl 3-[(phenylmethyl)carbamoylamino]propanoate Openeye Name: 2-acetylsulfanylethyl 3-(benzylcarbamoylamino)propanoate CAS Name: 3-[[oxo-[(phenylmethyl)amino]methyl]amino]propanoic acid 2-(acetylthio)ethyl ester IUPAC Name: 2-acetylsulfanylethyl 3-(benzylcarbamoylamino)propanoate Traditional Name: 3-(benzylcarbamoylamino)propionic acid 2-(acetylthio)ethyl ester Formula: C15H20N2O4S MolecularWeight: 324.3953

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCCOC(=O)CCNC(=O)NCC1=CC=CC=C1

Isomeric SMILES

CC(=O)SCCOC(=O)CCNC(=O)NCC1=CC=CC=C1

InChI

InChI=1S/C15H20N2O4S/c1-12(18)22-10-9-21-14(19)7-8-16-15(20)17-11-13-5-3-2-4-6-13/h2-6H,7-11H2,1H3,(H2,16,17,20)