diethyl 2-[2-[3-(4-ethoxy-3-ethoxycarbonyl-2-methyl-4-oxidanylidene-butan-2-yl)sulfanylphenyl]sulfanylpropan-2-yl]propanedioate

Systemtic Name: diethyl 2-[2-[3-(4-ethoxy-3-ethoxycarbonyl-2-methyl-4-oxidanylidene-butan-2-yl)sulfanylphenyl]sulfanylpropan-2-yl]propanedioate Openeye Name: diethyl 2-[1-[3-(3-ethoxy-2-ethoxycarbonyl-1,1-dimethyl-3-oxo-propyl)sulfanylphenyl]sulfanyl-1-methyl-ethyl]propanedioate CAS Name: 2-[2-[[3-[(4-ethoxy-3-ethoxycarbonyl-2-methyl-4-oxobutan-2-yl)thio]phenyl]thio]propan-2-yl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[2-[3-(4-ethoxy-3-ethoxycarbonyl-2-methyl-4-oxobutan-2-yl)sulfanylphenyl]sulfanylpropan-2-yl]propanedioate Traditional Name: 2-[1-[[3-[(2-carbethoxy-3-ethoxy-3-keto-1,1-dimethyl-propyl)thio]phenyl]thio]-1-methyl-ethyl]malonic acid diethyl ester Formula: C26H38O8S2 MolecularWeight: 542.70512

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)OCC)C(C)(C)SC1=CC(=CC=C1)SC(C)(C)C(C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(C(=O)OCC)C(C)(C)SC1=CC(=CC=C1)SC(C)(C)C(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C26H38O8S2/c1-9-31-21(27)19(22(28)32-10-2)25(5,6)35-17-14-13-15-18(16-17)36-26(7,8)20(23(29)33-11-3)24(30)34-12-4/h13-16,19-20H,9-12H2,1-8H3