Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-{2-[(2-chloro-6-fluorobenzyl)oxy]-3-methoxyphenyl}methylidene]-5-(morpholin-4-ylmethyl)-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STK552815
SMILES COc1cccc(c1OCc1c(F)cccc1Cl)/C=N/NC(=O)c1nnn(c1CN1CCOCC1)c1nonc1N
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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 C25H25ClFN9O5 MW 585.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25ClFN9O5/c1-38-20-7-2-4-15(22(20)40-14-16-17(26)5-3-6-18(16)27)12-29-31-25(37)21-19(13-35-8-10-39-11-9-35)36(34-30-21)24-23(28)32-41-33-24/h2-7,12H,8-11,13-14H2,1H3,(H2,28,32)(H,31,37)/b29-12+InChIKey
KUYHWWZRJCXCHT-XKJRVUDJSA-NSynonyms
(E)1(4amino125oxadiazol3yl)N(2((2chloro6fluorobenzyl)oxy)3methoxybenzylidene)5(morpholinomethyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(2((2chloro6fluorobenzyl)oxy)3methoxyphenyl)methylidene)5(morpholin4ylmethyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(2((2chloro6fluorophenyl)methoxy)3methoxyphenyl)methylideneamino)5(morpholin4ylmethyl)triazole4carboxamide
COC1=CC=CC(=C1OCC2=C(C=CC=C2Cl)F)C=NNC(=O)C3=C(N(N=N3)C4=NON=C4N)CN5CCOCC5
COc1cccc(c1OCc1c(F)cccc1Cl)C=NNC(=O)c1nnn(c1CN1CCOCC1)c1nonc1N
InChI=1SC25H25ClFN9O5c1382072415(22(20)40141617(26)53618(16)27)12293125(37)2119(13358103911935)36(343021)2423(28)32413324h2712H8111314H21H3(H22832)(H3137)b2912+
MFCD03296913
ZINC000097966714
ZINC102463154
Check stock
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Check stock on Vitas-MAvailable files
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