Vitas-M small molecule compound
2-amino-3-methyl-1-(3-phenoxypropyl)-1H-benzimidazol-3-ium
Catalog ID
STL420413
SMILES Nc1[n+](C)c2c(n1CCCOc1ccccc1)cccc2
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H20N3O MW 282.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19N3O/c1-19-15-10-5-6-11-16(15)20(17(19)18)12-7-13-21-14-8-3-2-4-9-14/h2-6,8-11,18H,7,12-13H2,1H3/p+1InChIKey
DGTLXPLVZSDGGH-UHFFFAOYSA-OSynonyms
1METHYL3(3PHENOXYPROPYL)BENZIMIDAZOL1IUM2AMINE
2AMINO3METHYL1(3PHENOXYPROPYL)1H31BENZIMIDAZOL3IUM
2amino3methyl1(3phenoxypropyl)1Hbenzimidazol3ium
C(N+)1=C(N(C2=CC=CC=C21)CCCOC3=CC=CC=C3)N
InChI=1SC17H19N3Oc1191510561116(15)20(17(19)18)1271321148324914h2681118H71213H21H3p+1
Nc1(n+)(C)c2c(n1CCCOc1ccccc1)cccc2
ZINC000019901271
ZINC02073192
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