methyl (2S,3R,4R)-4-(2,2-dimethylpropoxycarbothioylsulfanylmethyl)-5-oxidanylidene-2-pentyl-oxolane-3-carboxylate

Systemtic Name: methyl (2S,3R,4R)-4-(2,2-dimethylpropoxycarbothioylsulfanylmethyl)-5-oxidanylidene-2-pentyl-oxolane-3-carboxylate Openeye Name: methyl (2S,3R,4R)-4-(2,2-dimethylpropoxycarbothioylsulfanylmethyl)-5-oxo-2-pentyl-tetrahydrofuran-3-carboxylate CAS Name: (2S,3R,4R)-4-[[[2,2-dimethylpropoxy(sulfanylidene)methyl]thio]methyl]-5-oxo-2-pentyl-3-oxolanecarboxylic acid methyl ester IUPAC Name: methyl (2S,3R,4R)-4-(2,2-dimethylpropoxycarbothioylsulfanylmethyl)-5-oxo-2-pentyloxolane-3-carboxylate Traditional Name: (2S,3R,4R)-2-amyl-5-keto-4-[(neopentyloxycarbothioylthio)methyl]tetrahydrofuran-3-carboxylic acid methyl ester Formula: C18H30O5S2 MolecularWeight: 390.5578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C(C(C(=O)O1)CSC(=S)OCC(C)(C)C)C(=O)OC

Isomeric SMILES

CCCCC[C@H]1[C@@H]([C@H](C(=O)O1)CSC(=S)OCC(C)(C)C)C(=O)OC

InChI

InChI=1S/C18H30O5S2/c1-6-7-8-9-13-14(16(20)21-5)12(15(19)23-13)10-25-17(24)22-11-18(2,3)4/h12-14H,6-11H2,1-5H3/t12-,13+,14-/m1/s1