ethyl (2R,3R)-3-[(4-methylphenyl)sulfonylamino]-2-methylsulfanyl-3-phenyl-propanoate

Systemtic Name: ethyl (2R,3R)-3-[(4-methylphenyl)sulfonylamino]-2-methylsulfanyl-3-phenyl-propanoate Openeye Name: ethyl (2R,3R)-2-methylsulfanyl-3-phenyl-3-(p-tolylsulfonylamino)propanoate CAS Name: (2R,3R)-3-[(4-methylphenyl)sulfonylamino]-2-(methylthio)-3-phenylpropanoic acid ethyl ester IUPAC Name: ethyl (2R,3R)-3-[(4-methylphenyl)sulfonylamino]-2-methylsulfanyl-3-phenylpropanoate Traditional Name: (2R,3R)-2-(methylthio)-3-phenyl-3-(tosylamino)propionic acid ethyl ester Formula: C19H23NO4S2 MolecularWeight: 393.52022

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C)SC

Isomeric SMILES

CCOC(=O)[C@@H]([C@@H](C1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C)SC

InChI

InChI=1S/C19H23NO4S2/c1-4-24-19(21)18(25-3)17(15-8-6-5-7-9-15)20-26(22,23)16-12-10-14(2)11-13-16/h5-13,17-18,20H,4H2,1-3H3/t17-,18-/m1/s1