diethyl 3-[2,2-bis(fluoranyl)-2-phenyl-ethyl]sulfanylcarbonyloxy-4-methyl-thiophene-2,5-dicarboxylate

Systemtic Name: diethyl 3-[2,2-bis(fluoranyl)-2-phenyl-ethyl]sulfanylcarbonyloxy-4-methyl-thiophene-2,5-dicarboxylate Openeye Name: diethyl 3-(2,2-difluoro-2-phenyl-ethyl)sulfanylcarbonyloxy-4-methyl-thiophene-2,5-dicarboxylate CAS Name: 3-[[(2,2-difluoro-2-phenylethyl)thio]-oxomethoxy]-4-methylthiophene-2,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 3-(2,2-difluoro-2-phenylethyl)sulfanylcarbonyloxy-4-methylthiophene-2,5-dicarboxylate Traditional Name: 3-[(2,2-difluoro-2-phenyl-ethyl)thio]carbonyloxy-4-methyl-thiophene-2,5-dicarboxylic acid diethyl ester Formula: C20H20F2O6S2 MolecularWeight: 458.496006

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)C(=O)OCC)OC(=O)SCC(C2=CC=CC=C2)(F)F)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)C(=O)OCC)OC(=O)SCC(C2=CC=CC=C2)(F)F)C

InChI

InChI=1S/C20H20F2O6S2/c1-4-26-17(23)15-12(3)14(16(30-15)18(24)27-5-2)28-19(25)29-11-20(21,22)13-9-7-6-8-10-13/h6-10H,4-5,11H2,1-3H3