Vitas-M small molecule compound
ethyl 4-[(6-{(2E)-2-[2-(trifluoromethyl)benzylidene]hydrazinyl}[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl)amino]benzoate
Catalog ID
STK672806
SMILES CCOC(=O)c1ccc(cc1)Nc1nc2nonc2nc1N/N=C/c1ccccc1C(F)(F)F
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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 C21H16F3N7O3 MW 471.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16F3N7O3/c1-2-33-20(32)12-7-9-14(10-8-12)26-16-17(28-19-18(27-16)30-34-31-19)29-25-11-13-5-3-4-6-15(13)21(22,23)24/h3-11H,2H2,1H3,(H,26,27,30)(H,28,29,31)/b25-11+InChIKey
HCGMLGCFXNGTJE-OPEKNORGSA-NSynonyms
CCOC(=O)C1=CC=C(C=C1)NC2=NC3=NON=C3N=C2NN=CC4=CC=CC=C4C(F)(F)F
CCOC(=O)c1ccc(cc1)Nc1nc2nonc2nc1NN=Cc1ccccc1C(F)(F)F
ethyl4((5((2E)2((2(trifluoromethyl)phenyl)methylidene)hydrazinyl)(125)oxadiazolo(34b)pyrazin6yl)amino)benzoate
ethyl4((6((2E)2(2(trifluoromethyl)benzylidene)hydrazinyl)(125)oxadiazolo(34b)pyrazin5yl)amino)benzoate
InChI=1SC21H16F3N7O3c123320(32)127914(10812)261617(281918(2716)30343119)29251113534615(13)21(2223)24h311H2H21H3(H262730)(H282931)b2511+
MFCD00605766
ZINC000015162179
ZINC102777644
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