methyl 4-fluoranyl-3-(pyridin-3-ylmethylsulfamoyl)-1-benzothiophene-2-carboxylate

Systemtic Name: methyl 4-fluoranyl-3-(pyridin-3-ylmethylsulfamoyl)-1-benzothiophene-2-carboxylate Openeye Name: methyl 4-fluoro-3-(3-pyridylmethylsulfamoyl)benzothiophene-2-carboxylate CAS Name: 4-fluoro-3-(3-pyridinylmethylsulfamoyl)-1-benzothiophene-2-carboxylic acid methyl ester IUPAC Name: methyl 4-fluoro-3-(pyridin-3-ylmethylsulfamoyl)-1-benzothiophene-2-carboxylate Traditional Name: 4-fluoro-3-(3-pyridylmethylsulfamoyl)benzothiophene-2-carboxylic acid methyl ester Formula: C16H13FN2O4S2 MolecularWeight: 380.413823

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(C=CC=C2S1)F)S(=O)(=O)NCC3=CN=CC=C3

Isomeric SMILES

COC(=O)C1=C(C2=C(C=CC=C2S1)F)S(=O)(=O)NCC3=CN=CC=C3

InChI

InChI=1S/C16H13FN2O4S2/c1-23-16(20)14-15(13-11(17)5-2-6-12(13)24-14)25(21,22)19-9-10-4-3-7-18-8-10/h2-8,19H,9H2,1H3