Vitas-M small molecule compound
5-[(6-bromo-4,7-dimethoxy-1,3-benzodioxol-5-yl)methyl]-N'-[(Z)-(2-fluorophenyl)methylidene]-4,5-dihydro-1,2-oxazole-3-carbohydrazide
Catalog ID
STK693145
SMILES COc1c(CC2ON=C(C2)C(=O)N/N=C\c2ccccc2F)c(Br)c(c2c1OCO2)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 C21H19BrFN3O6 MW 508.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19BrFN3O6/c1-28-17-13(16(22)18(29-2)20-19(17)30-10-31-20)7-12-8-15(26-32-12)21(27)25-24-9-11-5-3-4-6-14(11)23/h3-6,9,12H,7-8,10H2,1-2H3,(H,25,27)/b24-9-InChIKey
YKHKXJRRXBHSCC-OPVMPGTRSA-NSynonyms
5((6bromo47dimethoxy13benzodioxol5yl)methyl)N((Z)(2fluorophenyl)methylidene)45dihydro12oxazole3carbohydrazide
5((6bromo47dimethoxy13benzodioxol5yl)methyl)N((Z)(2fluorophenyl)methylideneamino)45dihydro12oxazole3carboxamide
COC1=C(C(=C(C2=C1OCO2)OC)Br)CC3CC(=NO3)C(=O)NN=CC4=CC=CC=C4F
COc1c(CC2ON=C(C2)C(=O)NN=Cc2ccccc2F)c(Br)c(c2c1OCO2)OC
InChI=1SC21H19BrFN3O6c1281713(16(22)18(292)2019(17)30103120)712815(263212)21(27)2524911534614(11)23h36912H7810H212H3(H2527)b249
MFCD10039220
ZINC000015085972
ZINC000036556696
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