5-fluoranyl-N-(1-pyridin-1-ium-2-ylpiperidin-4-yl)-1-benzothiophene-2-carboxamide

Systemtic Name: 5-fluoranyl-N-(1-pyridin-1-ium-2-ylpiperidin-4-yl)-1-benzothiophene-2-carboxamide Openeye Name: 5-fluoro-N-(1-pyridin-1-ium-2-yl-4-piperidyl)benzothiophene-2-carboxamide CAS Name: 5-fluoro-N-[1-(2-pyridin-1-iumyl)-4-piperidinyl]-1-benzothiophene-2-carboxamide IUPAC Name: 5-fluoro-N-(1-pyridin-1-ium-2-ylpiperidin-4-yl)-1-benzothiophene-2-carboxamide Traditional Name: 5-fluoro-N-(1-pyridin-1-ium-2-yl-4-piperidyl)benzothiophene-2-carboxamide Formula: C19H19FN3OS+ MolecularWeight: 356.437063

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC3=C(S2)C=CC(=C3)F)C4=CC=CC=[NH+]4

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC3=C(S2)C=CC(=C3)F)C4=CC=CC=[NH+]4

InChI

InChI=1S/C19H18FN3OS/c20-14-4-5-16-13(11-14)12-17(25-16)19(24)22-15-6-9-23(10-7-15)18-3-1-2-8-21-18/h1-5,8,11-12,15H,6-7,9-10H2,(H,22,24)/p+1