6-fluoranyl-2-[4-methoxy-2-[(2-methoxy-2-methyl-propyl)sulfanylmethyl]-3-methyl-pyridin-1-ium-1-yl]-1H-benzimidazole

Systemtic Name: 6-fluoranyl-2-[4-methoxy-2-[(2-methoxy-2-methyl-propyl)sulfanylmethyl]-3-methyl-pyridin-1-ium-1-yl]-1H-benzimidazole Openeye Name: 6-fluoro-2-[4-methoxy-2-[(2-methoxy-2-methyl-propyl)sulfanylmethyl]-3-methyl-pyridin-1-ium-1-yl]-1H-benzimidazole CAS Name: 6-fluoro-2-[4-methoxy-2-[[(2-methoxy-2-methylpropyl)thio]methyl]-3-methyl-1-pyridin-1-iumyl]-1H-benzimidazole IUPAC Name: 6-fluoro-2-[4-methoxy-2-[(2-methoxy-2-methylpropyl)sulfanylmethyl]-3-methylpyridin-1-ium-1-yl]-1H-benzimidazole Traditional Name: 6-fluoro-2-[4-methoxy-2-[[(2-methoxy-2-methyl-propyl)thio]methyl]-3-methyl-pyridin-1-ium-1-yl]-1H-benzimidazole Formula: C20H25FN3O2S+ MolecularWeight: 390.494803

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C[N+](=C1CSCC(C)(C)OC)C2=NC3=C(N2)C=C(C=C3)F)OC

Isomeric SMILES

CC1=C(C=C[N+](=C1CSCC(C)(C)OC)C2=NC3=C(N2)C=C(C=C3)F)OC

InChI

InChI=1S/C20H25FN3O2S/c1-13-17(11-27-12-20(2,3)26-5)24(9-8-18(13)25-4)19-22-15-7-6-14(21)10-16(15)23-19/h6-10H,11-12H2,1-5H3,(H,22,23)/q+1