Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-N'-[(1E)-1-(4-methoxyphenyl)ethylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL346641
SMILES COc1ccc(cc1)/C(=N/NC(=O)c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N)/C
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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 C21H18N8O5 MW 462.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N8O5/c1-11(12-3-6-14(31-2)7-4-12)23-25-21(30)17-18(13-5-8-15-16(9-13)33-10-32-15)29(28-24-17)20-19(22)26-34-27-20/h3-9H,10H2,1-2H3,(H2,22,26)(H,25,30)/b23-11+InChIKey
UZVQGAJCPORLOQ-FOKLQQMPSA-NSynonyms
848986-90-3(E)1(4amino125oxadiazol3yl)5(benzo(d)(13)dioxol5yl)N(1(4methoxyphenyl)ethylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(13benzodioxol5yl)N((1E)1(4methoxyphenyl)ethylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(13benzodioxol5yl)N((E)1(4methoxyphenyl)ethylideneamino)triazole4carboxamide
848986903
CC(=NNC(=O)C1=C(N(N=N1)C2=NON=C2N)C3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)OC
COc1ccc(cc1)C(=NNC(=O)c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N)C
InChI=1SC21H18N8O5c111(123614(312)7412)232521(30)1718(13581516(913)33103215)29(282417)2019(22)26342720h39H10H212H3(H22226)(H2530)b2311+
MFCD05678534
ZINC000009233379
ZINC97492666
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