6-fluoranyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 6-fluoranyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-1-benzothiophene-2-carboxamide Openeye Name: 6-fluoro-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]benzothiophene-2-carboxamide CAS Name: 6-fluoro-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-1-benzothiophene-2-carboxamide IUPAC Name: 6-fluoro-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-1-benzothiophene-2-carboxamide Traditional Name: 6-fluoro-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]benzothiophene-2-carboxamide Formula: C19H19FN3O2S+ MolecularWeight: 372.436463

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)C3=CC4=C(S3)C=C(C=C4)F

Isomeric SMILES

C1COCCN1C2=[NH+]C=C(C=C2)CNC(=O)C3=CC4=C(S3)C=C(C=C4)F

InChI

InChI=1S/C19H18FN3O2S/c20-15-3-2-14-9-17(26-16(14)10-15)19(24)22-12-13-1-4-18(21-11-13)23-5-7-25-8-6-23/h1-4,9-11H,5-8,12H2,(H,22,24)/p+1