methyl 4-[3-(4-fluorophenyl)-4-sulfanylidene-chromen-2-yl]benzenesulfonate

Systemtic Name: methyl 4-[3-(4-fluorophenyl)-4-sulfanylidene-chromen-2-yl]benzenesulfonate Openeye Name: methyl 4-[3-(4-fluorophenyl)-4-thioxo-chromen-2-yl]benzenesulfonate CAS Name: 4-[3-(4-fluorophenyl)-4-sulfanylidene-1-benzopyran-2-yl]benzenesulfonic acid methyl ester IUPAC Name: methyl 4-[3-(4-fluorophenyl)-4-sulfanylidenechromen-2-yl]benzenesulfonate Traditional Name: 4-[3-(4-fluorophenyl)-4-thioxo-chromen-2-yl]benzenesulfonic acid methyl ester Formula: C22H15FO4S2 MolecularWeight: 426.480503

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Descriptors Computed from Structure

Canonical SMILES:

COS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=S)C3=CC=CC=C3O2)C4=CC=C(C=C4)F

Isomeric SMILES

COS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=S)C3=CC=CC=C3O2)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H15FO4S2/c1-26-29(24,25)17-12-8-15(9-13-17)21-20(14-6-10-16(23)11-7-14)22(28)18-4-2-3-5-19(18)27-21/h2-13H,1H3