2-methylsulfonylsulfanylethyl 2-[(3Z)-6-fluoranyl-2-methyl-3-[(4-methylsulfinylphenyl)methylidene]inden-1-yl]ethanoate

Systemtic Name: 2-methylsulfonylsulfanylethyl 2-[(3Z)-6-fluoranyl-2-methyl-3-[(4-methylsulfinylphenyl)methylidene]inden-1-yl]ethanoate Openeye Name: 2-methylsulfonylsulfanylethyl 2-[(3Z)-6-fluoro-2-methyl-3-[(4-methylsulfinylphenyl)methylene]inden-1-yl]acetate CAS Name: 2-[(3Z)-6-fluoro-2-methyl-3-[(4-methylsulfinylphenyl)methylidene]-1-indenyl]acetic acid 2-(methylsulfonylthio)ethyl ester IUPAC Name: 2-methylsulfonylsulfanylethyl 2-[(3Z)-6-fluoro-2-methyl-3-[(4-methylsulfinylphenyl)methylidene]inden-1-yl]acetate Traditional Name: 2-[(3Z)-6-fluoro-2-methyl-3-(4-methylsulfinylbenzylidene)inden-1-yl]acetic acid 2-(mesylthio)ethyl ester Formula: C23H23FO5S3 MolecularWeight: 494.619123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C1=CC3=CC=C(C=C3)S(=O)C)C=CC(=C2)F)CC(=O)OCCSS(=O)(=O)C

Isomeric SMILES

CC\1=C(C2=C(/C1=C\C3=CC=C(C=C3)S(=O)C)C=CC(=C2)F)CC(=O)OCCSS(=O)(=O)C

InChI

InChI=1S/C23H23FO5S3/c1-15-20(12-16-4-7-18(8-5-16)31(2)26)19-9-6-17(24)13-22(19)21(15)14-23(25)29-10-11-30-32(3,27)28/h4-9,12-13H,10-11,14H2,1-3H3/b20-12-