dimethyl (2R,3R)-2-ethoxycarbothioylsulfanyl-3-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]cyclobutane-1,1-dicarboxylate

Systemtic Name: dimethyl (2R,3R)-2-ethoxycarbothioylsulfanyl-3-[2-(4-fluorophenyl)-2-oxidanylidene-ethyl]cyclobutane-1,1-dicarboxylate Openeye Name: dimethyl (2R,3R)-2-ethoxycarbothioylsulfanyl-3-[2-(4-fluorophenyl)-2-oxo-ethyl]cyclobutane-1,1-dicarboxylate CAS Name: (2R,3R)-2-[[ethoxy(sulfanylidene)methyl]thio]-3-[2-(4-fluorophenyl)-2-oxoethyl]cyclobutane-1,1-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2R,3R)-2-ethoxycarbothioylsulfanyl-3-[2-(4-fluorophenyl)-2-oxoethyl]cyclobutane-1,1-dicarboxylate Traditional Name: (2R,3R)-2-(ethoxycarbothioylthio)-3-[2-(4-fluorophenyl)-2-keto-ethyl]cyclobutane-1,1-dicarboxylic acid dimethyl ester Formula: C19H21FO6S2 MolecularWeight: 428.494843

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)SC1C(CC1(C(=O)OC)C(=O)OC)CC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CCOC(=S)S[C@@H]1[C@H](CC1(C(=O)OC)C(=O)OC)CC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C19H21FO6S2/c1-4-26-18(27)28-15-12(9-14(21)11-5-7-13(20)8-6-11)10-19(15,16(22)24-2)17(23)25-3/h5-8,12,15H,4,9-10H2,1-3H3/t12-,15+/m0/s1