methyl 3-(2-phenylsulfanylethanoylamino)propanoate

Systemtic Name: methyl 3-(2-phenylsulfanylethanoylamino)propanoate Openeye Name: methyl 3-[(2-phenylsulfanylacetyl)amino]propanoate CAS Name: 3-[[1-oxo-2-(phenylthio)ethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[(2-phenylsulfanylacetyl)amino]propanoate Traditional Name: 3-[[2-(phenylthio)acetyl]amino]propionic acid methyl ester Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNC(=O)CSC1=CC=CC=C1

Isomeric SMILES

COC(=O)CCNC(=O)CSC1=CC=CC=C1

InChI

InChI=1S/C12H15NO3S/c1-16-12(15)7-8-13-11(14)9-17-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,13,14)