ethyl 2-(phenethylamino)-3-sulfanyl-propanoate

Systemtic Name: ethyl 2-(phenethylamino)-3-sulfanyl-propanoate Openeye Name: ethyl 2-(phenethylamino)-3-sulfanyl-propanoate CAS Name: 3-mercapto-2-(phenethylamino)propanoic acid ethyl ester IUPAC Name: ethyl 2-(phenethylamino)-3-sulfanylpropanoate Traditional Name: 3-mercapto-2-(phenethylamino)propionic acid ethyl ester Formula: C13H19NO2S MolecularWeight: 253.36046

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CS)NCCC1=CC=CC=C1

Isomeric SMILES

CCOC(=O)C(CS)NCCC1=CC=CC=C1

InChI

InChI=1S/C13H19NO2S/c1-2-16-13(15)12(10-17)14-9-8-11-6-4-3-5-7-11/h3-7,12,14,17H,2,8-10H2,1H3