ethyl 2-azanyl-4-phenylsulfanyl-butanoate

Systemtic Name: ethyl 2-azanyl-4-phenylsulfanyl-butanoate Openeye Name: ethyl 2-amino-4-phenylsulfanyl-butanoate CAS Name: 2-amino-4-(phenylthio)butanoic acid ethyl ester IUPAC Name: ethyl 2-amino-4-phenylsulfanylbutanoate Traditional Name: 2-amino-4-(phenylthio)butyric acid ethyl ester Formula: C12H17NO2S MolecularWeight: 239.33388

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CCSC1=CC=CC=C1)N

Isomeric SMILES

CCOC(=O)C(CCSC1=CC=CC=C1)N

InChI

InChI=1S/C12H17NO2S/c1-2-15-12(14)11(13)8-9-16-10-6-4-3-5-7-10/h3-7,11H,2,8-9,13H2,1H3