Vitas-M small molecule compound

(2-{(E)-[2-(1H-benzimidazol-5-ylcarbonyl)hydrazinylidene]methyl}phenoxy)acetic acid

Catalog ID
STL043400
SMILES OC(=O)COc1ccccc1/C=N/NC(=O)c1ccc2c(c1)nc[nH]2

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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 C17H14N4O4 MW 338.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N4O4/c22-16(23)9-25-15-4-2-1-3-12(15)8-20-21-17(24)11-5-6-13-14(7-11)19-10-18-13/h1-8,10H,9H2,(H,18,19)(H,21,24)(H,22,23)/b20-8+
InChIKey
NOTCWCJBDALGTL-DNTJNYDQSA-N
Synonyms
496798-48-2
(2((E)(2(1Hbenzimidazol5ylcarbonyl)hydrazinylidene)methyl)phenoxy)aceticacid
(E)2(2((2(1Hbenzo(d)imidazole6carbonyl)hydrazono)methyl)phenoxy)aceticacid
2(2((1E)2(BENZIMIDAZOL6YLCARBONYLAMINO)2AZAVINYL)PHENOXY)ACETICACID
2(2((E)(3Hbenzimidazole5carbonylhydrazinylidene)methyl)phenoxy)aceticacid
496798482
C1=CC=C(C(=C1)C=NNC(=O)C2=CC3=C(C=C2)N=CN3)OCC(=O)O
InChI=1SC17H14N4O4c2216(23)92515421312(15)8202117(24)11561314(711)19101813h1810H9H2(H1819)(H2124)(H2223)b208+
MFCD03814965
OC(=O)COc1ccccc1C=NNC(=O)c1ccc2c(c1)(nH)cn2
OC(=O)COc1ccccc1C=NNC(=O)c1ccc2c(c1)nc(nH)2
ZINC000001252719
ZINC5729397

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Available files

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