ethyl 3-(3-fluorophenyl)sulfinyl-6-(pyridin-3-ylmethoxy)-1-benzothiophene-2-carboxylate

Systemtic Name: ethyl 3-(3-fluorophenyl)sulfinyl-6-(pyridin-3-ylmethoxy)-1-benzothiophene-2-carboxylate Openeye Name: ethyl 3-(3-fluorophenyl)sulfinyl-6-(3-pyridylmethoxy)benzothiophene-2-carboxylate CAS Name: 3-(3-fluorophenyl)sulfinyl-6-(3-pyridinylmethoxy)-1-benzothiophene-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(3-fluorophenyl)sulfinyl-6-(pyridin-3-ylmethoxy)-1-benzothiophene-2-carboxylate Traditional Name: 3-(3-fluorophenyl)sulfinyl-6-(3-pyridylmethoxy)benzothiophene-2-carboxylic acid ethyl ester Formula: C23H18FNO4S2 MolecularWeight: 455.521723

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(S1)C=C(C=C2)OCC3=CN=CC=C3)S(=O)C4=CC=CC(=C4)F

Isomeric SMILES

CCOC(=O)C1=C(C2=C(S1)C=C(C=C2)OCC3=CN=CC=C3)S(=O)C4=CC=CC(=C4)F

InChI

InChI=1S/C23H18FNO4S2/c1-2-28-23(26)21-22(31(27)18-7-3-6-16(24)11-18)19-9-8-17(12-20(19)30-21)29-14-15-5-4-10-25-13-15/h3-13H,2,14H2,1H3