Vitas-M small molecule compound

2-(4-{(E)-[2-(cyanoacetyl)hydrazinylidene]methyl}-2-ethoxyphenoxy)-N-(2-methoxyphenyl)acetamide

Catalog ID
STK362646
SMILES CCOc1cc(/C=N/NC(=O)CC#N)ccc1OCC(=O)Nc1ccccc1OC

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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 C21H22N4O5 MW 410.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4O5/c1-3-29-19-12-15(13-23-25-20(26)10-11-22)8-9-18(19)30-14-21(27)24-16-6-4-5-7-17(16)28-2/h4-9,12-13H,3,10,14H2,1-2H3,(H,24,27)(H,25,26)/b23-13+
InChIKey
AQNYFLIAGRWKOF-YDZHTSKRSA-N
Synonyms

2(4((E)(2(CYANOACETYL)HYDRAZINYLIDENE)METHYL)2ETHOXYPHENOXY)N(2METHOXYPHENYL)ACETAMIDE
2cyanoN((E)(3ethoxy4(2(2methoxyanilino)2oxoethoxy)phenyl)methylideneamino)acetamide
CCOC1=C(C=CC(=C1)C=NNC(=O)CC#N)OCC(=O)NC2=CC=CC=C2OC
CCOc1cc(C=NNC(=O)CC#N)ccc1OCC(=O)Nc1ccccc1OC
InChI=1SC21H22N4O5c1329191215(13232520(26)101122)8918(19)301421(27)2416645717(16)282h491213H31014H212H3(H2427)(H2526)b2313+
MFCD03835450
N((1E)2(3ETHOXY4((N(2METHOXYPHENYL)CARBAMOYL)METHOXY)PHENYL)1AZAVINYL)2CYANOACETAMIDE
ZINC000004545619
ZINC34378966

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Available files

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