[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 3-(furan-2-ylcarbonylamino)propanoate

Systemtic Name: [2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 3-(furan-2-ylcarbonylamino)propanoate Openeye Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 3-(furan-2-carbonylamino)propanoate CAS Name: 3-[[2-furanyl(oxo)methyl]amino]propanoic acid [2-oxo-2-[2-(phenylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 3-(furan-2-carbonylamino)propanoate Traditional Name: 3-(2-furoylamino)propionic acid [2-keto-2-[2-(phenylthio)ethylamino]ethyl] ester Formula: C18H20N2O5S MolecularWeight: 376.4268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCNC(=O)COC(=O)CCNC(=O)C2=CC=CO2

Isomeric SMILES

C1=CC=C(C=C1)SCCNC(=O)COC(=O)CCNC(=O)C2=CC=CO2

InChI

InChI=1S/C18H20N2O5S/c21-16(19-10-12-26-14-5-2-1-3-6-14)13-25-17(22)8-9-20-18(23)15-7-4-11-24-15/h1-7,11H,8-10,12-13H2,(H,19,21)(H,20,23)