diethyl 2-[4-[(2S,4R,5R)-2-methyl-5-methylsulfanylcarbothioyloxy-1,3-dioxan-4-yl]butan-2-ylidene]propanedioate

Systemtic Name: diethyl 2-[4-[(2S,4R,5R)-2-methyl-5-methylsulfanylcarbothioyloxy-1,3-dioxan-4-yl]butan-2-ylidene]propanedioate Openeye Name: diethyl 2-[1-methyl-3-[(2S,4R,5R)-2-methyl-5-methylsulfanylcarbothioyloxy-1,3-dioxan-4-yl]propylidene]propanedioate CAS Name: 2-[4-[(2S,4R,5R)-2-methyl-5-[(methylthio)-sulfanylidenemethoxy]-1,3-dioxan-4-yl]butan-2-ylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[4-[(2S,4R,5R)-2-methyl-5-methylsulfanylcarbothioyloxy-1,3-dioxan-4-yl]butan-2-ylidene]propanedioate Traditional Name: 2-[1-methyl-3-[(2S,4R,5R)-2-methyl-5-(methylthio)carbothioyloxy-1,3-dioxan-4-yl]propylidene]malonic acid diethyl ester Formula: C18H28O7S2 MolecularWeight: 420.54072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=C(C)CCC1C(COC(O1)C)OC(=S)SC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(=C(C)CC[C@@H]1[C@@H](CO[C@@H](O1)C)OC(=S)SC)C(=O)OCC

InChI

InChI=1S/C18H28O7S2/c1-6-21-16(19)15(17(20)22-7-2)11(3)8-9-13-14(25-18(26)27-5)10-23-12(4)24-13/h12-14H,6-10H2,1-5H3/t12-,13+,14+/m0/s1