methyl 2-azanyl-3-phenethylsulfanyl-propanoate

Systemtic Name: methyl 2-azanyl-3-phenethylsulfanyl-propanoate Openeye Name: methyl 2-amino-3-phenethylsulfanyl-propanoate CAS Name: 2-amino-3-(phenethylthio)propanoic acid methyl ester IUPAC Name: methyl 2-amino-3-phenethylsulfanylpropanoate Traditional Name: 2-amino-3-(phenethylthio)propionic acid methyl ester Formula: C12H17NO2S MolecularWeight: 239.33388

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CSCCC1=CC=CC=C1)N

Isomeric SMILES

COC(=O)C(CSCCC1=CC=CC=C1)N

InChI

InChI=1S/C12H17NO2S/c1-15-12(14)11(13)9-16-8-7-10-5-3-2-4-6-10/h2-6,11H,7-9,13H2,1H3