(4-methoxyphenyl)sulfonyl 2-azanyl-3-(2-hydroxyethylsulfanyl)-2-methyl-propanoate

Systemtic Name: (4-methoxyphenyl)sulfonyl 2-azanyl-3-(2-hydroxyethylsulfanyl)-2-methyl-propanoate Openeye Name: (4-methoxyphenyl)sulfonyl 2-amino-3-(2-hydroxyethylsulfanyl)-2-methyl-propanoate CAS Name: 2-amino-3-(2-hydroxyethylthio)-2-methylpropanoic acid (4-methoxyphenyl)sulfonyl ester IUPAC Name: (4-methoxyphenyl)sulfonyl 2-amino-3-(2-hydroxyethylsulfanyl)-2-methylpropanoate Traditional Name: 2-amino-3-(2-hydroxyethylthio)-2-methyl-propionic acid (4-methoxyphenyl)sulfonyl ester Formula: C13H19NO6S2 MolecularWeight: 349.42306

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSCCO)(C(=O)OS(=O)(=O)C1=CC=C(C=C1)OC)N

Isomeric SMILES

CC(CSCCO)(C(=O)OS(=O)(=O)C1=CC=C(C=C1)OC)N

InChI

InChI=1S/C13H19NO6S2/c1-13(14,9-21-8-7-15)12(16)20-22(17,18)11-5-3-10(19-2)4-6-11/h3-6,15H,7-9,14H2,1-2H3