Vitas-M small molecule compound
1-butyl-3-phenyl-1,5,6,7-tetrahydropyrrolo[1,2-a]imidazol-4-ium
Catalog ID
STL048790
SMILES CCCCn1cc([n+]2c1CCC2)c1ccccc1
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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 C16H21N2 MW 241.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21N2/c1-2-3-11-17-13-15(14-8-5-4-6-9-14)18-12-7-10-16(17)18/h4-6,8-9,13H,2-3,7,10-12H2,1H3/q+1InChIKey
LUWAQBBKMMOUPS-UHFFFAOYSA-NSynonyms
1butyl3phenyl1567tetrahydropyrrolo(12a)imidazol4ium
CCCC(N+)1=C2CCCN2C(=C1)C3=CC=CC=C3
CCCCn1cc((n+)2c1CCC2)c1ccccc1
InChI=1SC16H21N2c12311171315(148546914)181271016(17)18h468913H2371012H21H3q+1
ZINC000016956302
ZINC16956302
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