methyl (2S)-3-(2-hydroxyethylsulfanyl)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butanoate

Systemtic Name: methyl (2S)-3-(2-hydroxyethylsulfanyl)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butanoate Openeye Name: methyl (2S)-3-(2-hydroxyethylsulfanyl)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butanoate CAS Name: (2S)-3-(2-hydroxyethylthio)-2-[(4-methoxyphenyl)sulfonylamino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2S)-3-(2-hydroxyethylsulfanyl)-2-[(4-methoxyphenyl)sulfonylamino]-3-methylbutanoate Traditional Name: (2S)-3-(2-hydroxyethylthio)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-butyric acid methyl ester Formula: C15H23NO6S2 MolecularWeight: 377.47622

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(C(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)OC)SCCO

Isomeric SMILES

CC(C)([C@H](C(=O)OC)NS(=O)(=O)C1=CC=C(C=C1)OC)SCCO

InChI

InChI=1S/C15H23NO6S2/c1-15(2,23-10-9-17)13(14(18)22-4)16-24(19,20)12-7-5-11(21-3)6-8-12/h5-8,13,16-17H,9-10H2,1-4H3/t13-/m0/s1