Vitas-M small molecule compound

N'-[(E)-(2,3,4-trimethoxyphenyl)methylidene]-1H-benzimidazole-5-carbohydrazide

Catalog ID
STK641618
SMILES COc1c(/C=N/NC(=O)c2ccc3c(c2)nc[nH]3)ccc(c1OC)OC

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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 C18H18N4O4 MW 354.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4O4/c1-24-15-7-5-12(16(25-2)17(15)26-3)9-21-22-18(23)11-4-6-13-14(8-11)20-10-19-13/h4-10H,1-3H3,(H,19,20)(H,22,23)/b21-9+
InChIKey
IGSBHJWBAHMGLF-ZVBGSRNCSA-N
Synonyms
487023-08-5
(E)N(234trimethoxybenzylidene)1Hbenzo(d)imidazole6carbohydrazide
3HBENZOIMIDAZOLE5CARBOXYLICACID(1(234TRIMETHOXYPHENYL)METH(E)YLIDENE)HYDRAZIDE
487023085
COC1=C(C(=C(C=C1)C=NNC(=O)C2=CC3=C(C=C2)N=CN3)OC)OC
COc1c(C=NNC(=O)c2ccc3c(c2)(nH)cn3)ccc(c1OC)OC
COc1c(C=NNC(=O)c2ccc3c(c2)nc(nH)3)ccc(c1OC)OC
InChI=1SC18H18N4O4c124157512(16(252)17(15)263)9212218(23)11461314(811)20101913h410H13H3(H1920)(H2223)b219+
MFCD18162702
N((1E)2(234TRIMETHOXYPHENYL)1AZAVINYL)BENZIMIDAZOL6YLCARBOXAMIDE
N((E)(234trimethoxyphenyl)methylidene)1Hbenzimidazole5carbohydrazide
N((E)(234trimethoxyphenyl)methylideneamino)3Hbenzimidazole5carboxamide
ZINC000013635479
ZINC15979298

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Available files

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