methyl 2-azanyl-3-(phenylcarbonylsulfanyl)propanoate

Systemtic Name: methyl 2-azanyl-3-(phenylcarbonylsulfanyl)propanoate Openeye Name: methyl 2-amino-3-benzoylsulfanyl-propanoate CAS Name: 2-amino-3-(benzoylthio)propanoic acid methyl ester IUPAC Name: methyl 2-amino-3-benzoylsulfanylpropanoate Traditional Name: 2-amino-3-(benzoylthio)propionic acid methyl ester Formula: C11H13NO3S MolecularWeight: 239.29082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H13NO3S/c1-15-10(13)9(12)7-16-11(14)8-5-3-2-4-6-8/h2-6,9H,7,12H2,1H3