Vitas-M small molecule compound

4-methyl-2-{[(1-methyl-1H-3,1-benzimidazol-3-ium-2-yl)amino]methyl}phenolate

Catalog ID
STK564041
SMILES Cc1ccc(c(c1)CNc1[nH+]c2c(n1C)cccc2)[O-]

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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 C16H17N3O MW 267.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N3O/c1-11-7-8-15(20)12(9-11)10-17-16-18-13-5-3-4-6-14(13)19(16)2/h3-9,20H,10H2,1-2H3,(H,17,18)
InChIKey
ASGKAEJPRPODHE-UHFFFAOYSA-N
Synonyms
371926-00-0
4methyl2(((1methyl1H31benzimidazol3ium2yl)amino)methyl)phenolate
Cc1ccc(c(c1)CNc1(nH+)c2c(n1C)cccc2)(O)
Registry IDs
MFCD02735999
ZINC000000285486

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.