1-(chloromethyl)-5-methoxy-2-[(R)-(4-methoxy-3,5-dimethyl-pyridin-1-ium-2-yl)methylsulfinyl]benzimidazole

Systemtic Name: 1-(chloromethyl)-5-methoxy-2-[(R)-(4-methoxy-3,5-dimethyl-pyridin-1-ium-2-yl)methylsulfinyl]benzimidazole Openeye Name: 1-(chloromethyl)-5-methoxy-2-[(R)-(4-methoxy-3,5-dimethyl-pyridin-1-ium-2-yl)methylsulfinyl]benzimidazole CAS Name: 1-(chloromethyl)-5-methoxy-2-[(R)-(4-methoxy-3,5-dimethyl-2-pyridin-1-iumyl)methylsulfinyl]benzimidazole IUPAC Name: 1-(chloromethyl)-5-methoxy-2-[(R)-(4-methoxy-3,5-dimethylpyridin-1-ium-2-yl)methylsulfinyl]benzimidazole Traditional Name: 1-(chloromethyl)-5-methoxy-2-[(R)-(4-methoxy-3,5-dimethyl-pyridin-1-ium-2-yl)methylsulfinyl]benzimidazole Formula: C18H21ClN3O3S+ MolecularWeight: 394.89564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C[NH+]=C(C(=C1OC)C)CS(=O)C2=NC3=C(N2CCl)C=CC(=C3)OC

Isomeric SMILES

CC1=C[NH+]=C(C(=C1OC)C)C[S@@](=O)C2=NC3=C(N2CCl)C=CC(=C3)OC

InChI

InChI=1S/C18H20ClN3O3S/c1-11-8-20-15(12(2)17(11)25-4)9-26(23)18-21-14-7-13(24-3)5-6-16(14)22(18)10-19/h5-8H,9-10H2,1-4H3/p+1/t26-/m1/s1