Vitas-M small molecule compound
5-(4,6-dibromo-7-methoxy-1,3-benzodioxol-5-yl)-4-methyl-N'-[(E)-(3-methylphenyl)methylidene]-4,5-dihydro-1,2-oxazole-3-carbohydrazide
Catalog ID
STK693128
SMILES COc1c(Br)c(C2ON=C(C2C)C(=O)N/N=C/c2cccc(c2)C)c(c2c1OCO2)Br
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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 C21H19Br2N3O5 MW 553.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19Br2N3O5/c1-10-5-4-6-12(7-10)8-24-25-21(27)16-11(2)17(31-26-16)13-14(22)18(28-3)20-19(15(13)23)29-9-30-20/h4-8,11,17H,9H2,1-3H3,(H,25,27)/b24-8+InChIKey
LYPBVXVFWBVETA-KTZMUZOWSA-NSynonyms
5(46dibromo7methoxy13benzodioxol5yl)4methylN((E)(3methylphenyl)methylidene)45dihydro12oxazole3carbohydrazide
5(46dibromo7methoxy13benzodioxol5yl)4methylN((E)(3methylphenyl)methylideneamino)45dihydro12oxazole3carboxamide
CC1C(ON=C1C(=O)NN=CC2=CC(=CC=C2)C)C3=C(C4=C(C(=C3Br)OC)OCO4)Br
COc1c(Br)c(C2ON=C(C2C)C(=O)NN=Cc2cccc(c2)C)c(c2c1OCO2)Br
InChI=1SC21H19Br2N3O5c11054612(710)8242521(27)1611(2)17(312616)1314(22)18(283)2019(15(13)23)2993020h481117H9H213H3(H2527)b248+
MFCD10039207
ZINC000100238940
ZINC000100238944
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