3-(2-methylpropylsulfanyl)-2-(2-methylpropylsulfanylmethyl)-4-oxidanyl-5-oxidanylidene-furan-2-carboxylic acid

Systemtic Name: 3-(2-methylpropylsulfanyl)-2-(2-methylpropylsulfanylmethyl)-4-oxidanyl-5-oxidanylidene-furan-2-carboxylic acid Openeye Name: 4-hydroxy-3-isobutylsulfanyl-2-(isobutylsulfanylmethyl)-5-oxo-furan-2-carboxylic acid CAS Name: 4-hydroxy-3-(2-methylpropylthio)-2-[(2-methylpropylthio)methyl]-5-oxo-2-furancarboxylic acid IUPAC Name: 4-hydroxy-3-(2-methylpropylsulfanyl)-2-(2-methylpropylsulfanylmethyl)-5-oxofuran-2-carboxylic acid Traditional Name: 4-hydroxy-3-(isobutylthio)-2-[(isobutylthio)methyl]-5-keto-2-furoic acid Formula: C14H22O5S2 MolecularWeight: 334.45148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSCC1(C(=C(C(=O)O1)O)SCC(C)C)C(=O)O

Isomeric SMILES

CC(C)CSCC1(C(=C(C(=O)O1)O)SCC(C)C)C(=O)O

InChI

InChI=1S/C14H22O5S2/c1-8(2)5-20-7-14(13(17)18)11(21-6-9(3)4)10(15)12(16)19-14/h8-9,15H,5-7H2,1-4H3,(H,17,18)