methyl 2-(ethylsulfonylamino)-3-(phenylmethylsulfanyl)propanoate

Systemtic Name: methyl 2-(ethylsulfonylamino)-3-(phenylmethylsulfanyl)propanoate Openeye Name: methyl 3-benzylsulfanyl-2-(ethylsulfonylamino)propanoate CAS Name: 2-(ethylsulfonylamino)-3-(phenylmethylthio)propanoic acid methyl ester IUPAC Name: methyl 3-benzylsulfanyl-2-(ethylsulfonylamino)propanoate Traditional Name: 3-(benzylthio)-2-(esylamino)propionic acid methyl ester Formula: C13H19NO4S2 MolecularWeight: 317.42426

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC(CSCC1=CC=CC=C1)C(=O)OC

Isomeric SMILES

CCS(=O)(=O)NC(CSCC1=CC=CC=C1)C(=O)OC

InChI

InChI=1S/C13H19NO4S2/c1-3-20(16,17)14-12(13(15)18-2)10-19-9-11-7-5-4-6-8-11/h4-8,12,14H,3,9-10H2,1-2H3