methyl 7-[3-[4-(3-methoxyphenyl)sulfanyl-3-oxidanyl-butyl]-2-oxidanylidene-1,3-thiazolidin-4-yl]heptanoate

Systemtic Name: methyl 7-[3-[4-(3-methoxyphenyl)sulfanyl-3-oxidanyl-butyl]-2-oxidanylidene-1,3-thiazolidin-4-yl]heptanoate Openeye Name: methyl 7-[3-[3-hydroxy-4-(3-methoxyphenyl)sulfanyl-butyl]-2-oxo-thiazolidin-4-yl]heptanoate CAS Name: 7-[3-[3-hydroxy-4-[(3-methoxyphenyl)thio]butyl]-2-oxo-4-thiazolidinyl]heptanoic acid methyl ester IUPAC Name: methyl 7-[3-[3-hydroxy-4-(3-methoxyphenyl)sulfanylbutyl]-2-oxo-1,3-thiazolidin-4-yl]heptanoate Traditional Name: 7-[3-[3-hydroxy-4-[(3-methoxyphenyl)thio]butyl]-2-keto-thiazolidin-4-yl]enanthic acid methyl ester Formula: C22H33NO5S2 MolecularWeight: 455.63112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC=C1)SCC(CCN2C(CSC2=O)CCCCCCC(=O)OC)O

Isomeric SMILES

COC1=CC(=CC=C1)SCC(CCN2C(CSC2=O)CCCCCCC(=O)OC)O

InChI

InChI=1S/C22H33NO5S2/c1-27-19-9-7-10-20(14-19)29-16-18(24)12-13-23-17(15-30-22(23)26)8-5-3-4-6-11-21(25)28-2/h7,9-10,14,17-18,24H,3-6,8,11-13,15-16H2,1-2H3