6-methoxy-2-[(S)-(4-methoxy-3,5-dimethyl-pyridin-1-ium-2-yl)methylsulfinyl]-1H-benzimidazole

Systemtic Name: 6-methoxy-2-[(S)-(4-methoxy-3,5-dimethyl-pyridin-1-ium-2-yl)methylsulfinyl]-1H-benzimidazole Openeye Name: 6-methoxy-2-[(S)-(4-methoxy-3,5-dimethyl-pyridin-1-ium-2-yl)methylsulfinyl]-1H-benzimidazole CAS Name: 6-methoxy-2-[(S)-(4-methoxy-3,5-dimethyl-2-pyridin-1-iumyl)methylsulfinyl]-1H-benzimidazole IUPAC Name: 6-methoxy-2-[(S)-(4-methoxy-3,5-dimethylpyridin-1-ium-2-yl)methylsulfinyl]-1H-benzimidazole Traditional Name: 6-methoxy-2-[(S)-(4-methoxy-3,5-dimethyl-pyridin-1-ium-2-yl)methylsulfinyl]-1H-benzimidazole Formula: C17H20N3O3S+ MolecularWeight: 346.424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[NH+]=C(C(=C1OC)C)CS(=O)C2=NC3=C(N2)C=C(C=C3)OC

Isomeric SMILES

CC1=C[NH+]=C(C(=C1OC)C)C[S@](=O)C2=NC3=C(N2)C=C(C=C3)OC

InChI

InChI=1S/C17H19N3O3S/c1-10-8-18-15(11(2)16(10)23-4)9-24(21)17-19-13-6-5-12(22-3)7-14(13)20-17/h5-8H,9H2,1-4H3,(H,19,20)/p+1/t24-/m0/s1