Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{3-ethoxy-4-[(2-fluorobenzyl)oxy]phenyl}methylidene]-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STK545657
SMILES CCOc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)ccc1OCc1ccccc1F
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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 C27H23FN8O4 MW 542.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23FN8O4/c1-2-38-22-14-17(12-13-21(22)39-16-19-10-6-7-11-20(19)28)15-30-32-27(37)23-24(18-8-4-3-5-9-18)36(35-31-23)26-25(29)33-40-34-26/h3-15H,2,16H2,1H3,(H2,29,33)(H,32,37)/b30-15+InChIKey
PIDVMDUSNSTOJQ-FJEPWZHXSA-NSynonyms
799772-93-3(E)1(4amino125oxadiazol3yl)N(3ethoxy4((2fluorobenzyl)oxy)benzylidene)5phenyl1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(3ethoxy4((2fluorobenzyl)oxy)phenyl)methylidene)5phenyl1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)N((E)(3ETHOXY4((2FLUOROPHENYL)METHOXY)PHENYL)METHYLIDENEAMINO)5PHENYLTRIAZOLE4CARBOXAMIDE
799772933
CCOC1=C(C=CC(=C1)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)C4=CC=CC=C4)OCC5=CC=CC=C5F
CCOc1cc(C=NNC(=O)c2nnn(c2c2ccccc2)c2nonc2N)ccc1OCc1ccccc1F
InChI=1SC27H23FN8O4c1238221417(121321(22)39161910671120(19)28)15303227(37)2324(188435918)36(353123)2625(29)33403426h315H216H21H3(H22933)(H3237)b3015+
MFCD03333156
ZINC000002205979
ZINC102442248
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