Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(2,4-dinitrophenoxy)-3-methoxyphenyl]methylidene}-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STK547703
SMILES COc1cc(/C=N/NC(=O)c2nnn(c2c2ccccc2)c2nonc2N)ccc1Oc1ccc(cc1[N+](=O)[O-])[N+](=O)[O-]
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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 C25H18N10O8 MW 586.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H18N10O8/c1-41-20-11-14(7-9-19(20)42-18-10-8-16(34(37)38)12-17(18)35(39)40)13-27-29-25(36)21-22(15-5-3-2-4-6-15)33(32-28-21)24-23(26)30-43-31-24/h2-13H,1H3,(H2,26,30)(H,29,36)/b27-13+InChIKey
RBSXXFCNFIJQEY-UVHMKAGCSA-NSynonyms
(E)1(4amino125oxadiazol3yl)N(4(24dinitrophenoxy)3methoxybenzylidene)5phenyl1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(4(24dinitrophenoxy)3methoxyphenyl)methylidene)5phenyl1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(4(24dinitrophenoxy)3methoxyphenyl)methylideneamino)5phenyltriazole4carboxamide
COC1=C(C=CC(=C1)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)C4=CC=CC=C4)OC5=C(C=C(C=C5)(N+)(=O)(O))(N+)(=O)(O)
COc1cc(C=NNC(=O)c2nnn(c2c2ccccc2)c2nonc2N)ccc1Oc1ccc(cc1(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC25H18N10O8c141201114(7919(20)421810816(34(37)38)1217(18)35(39)40)13272925(36)2122(155324615)33(322821)2423(26)30433124h213H1H3(H22630)(H2936)b2713+
MFCD03300348
ZINC000102448613
ZINC102448611
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.