| SpectraBase Spectrum ID |
JsCdnkMvwAm |
| Name |
2-{4'-[(3"-Methoxypropoxy)-3'-methyl-1'-oxidopyridin-2'-yl]methylsulfanyl}-1H-benzoimidazole |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H21N3O3S |
| InChI |
InChI=1S/C18H21N3O3S/c1-13-16(21(22)9-8-17(13)24-11-5-10-23-2)12-25-18-19-14-6-3-4-7-15(14)20-18/h3-4,6-9H,5,10-12H2,1-2H3,(H,19,20) |
| InChIKey |
CGSOUPMFBQXHAH-UHFFFAOYSA-N |
| Molecular Weight |
359.444 g/mol |
| SMILES |
[nH]1c2ccccc2nc1SCc1[n+](ccc(OCCCOC)c1C)[O-] |
| SPLASH |
splash10-0a4i-0009000000-f3c5023359ee0b45f7d0 |
| Source of Spectrum |
AJ-43-1452-13 |
| Synonyms |
2-[[4-(3-methoxypropoxy)-3-methyl-1-oxido-2-pyridin-1-iumyl]methylthio]-1H-benzimidazole
2-[[4-(3-methoxypropoxy)-3-methyl-1-oxidopyridin-1-ium-2-yl]methylsulfanyl]-1H-benzimidazole
2-[[4-(3-methoxypropoxy)-3-methyl-1-oxido-pyridin-1-ium-2-yl]methylsulfanyl]-1H-benzimidazole
2-[[4-(3-methoxypropoxy)-3-methyl-1-oxidanidyl-pyridin-1-ium-2-yl]methylsulfanyl]-1H-benzimidazole |
| Wiley ID |
1594345 |
![2-{4'-[(3"-Methoxypropoxy)-3'-methyl-1'-oxidopyridin-2'-yl]methylsulfanyl}-1H-benzoimidazole](/api/spectrum/JsCdnkMvwAm/structure.png?h=300&w=458 "2-{4'-[(3\"-Methoxypropoxy)-3'-methyl-1'-oxidopyridin-2'-yl]methylsulfanyl}-1H-benzoimidazole")
