Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-N'-[(E)-(2-chloro-6-fluorophenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL347165
SMILES O=C(c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N)N/N=C/c1c(F)cccc1Cl
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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 C19H12ClFN8O4 MW 470.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H12ClFN8O4/c20-11-2-1-3-12(21)10(11)7-23-25-19(30)15-16(9-4-5-13-14(6-9)32-8-31-13)29(28-24-15)18-17(22)26-33-27-18/h1-7H,8H2,(H2,22,26)(H,25,30)/b23-7+InChIKey
BRRJCHWLSWDNKN-HCGXMYGOSA-NSynonyms
849019-79-0(E)1(4amino125oxadiazol3yl)5(benzo(d)(13)dioxol5yl)N(2chloro6fluorobenzylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(13benzodioxol5yl)N((E)(2chloro6fluorophenyl)methylidene)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)5(13BENZODIOXOL5YL)N((E)(2CHLORO6FLUOROPHENYL)METHYLIDENEAMINO)TRIAZOLE4CARBOXAMIDE
849019790
C1OC2=C(O1)C=C(C=C2)C3=C(N=NN3C4=NON=C4N)C(=O)NN=CC5=C(C=CC=C5Cl)F
InChI=1SC19H12ClFN8O4c201121312(21)10(11)7232519(30)1516(9451314(69)3283113)29(282415)1817(22)26332718h17H8H2(H22226)(H2530)b237+
MFCD05681091
O=C(c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N)NN=Cc1c(F)cccc1Cl
ZINC000002452902
ZINC15978529
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