Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{(E)-[4-(2,4-dinitrophenoxy)-3-ethoxyphenyl]methylidene}-5-(3-nitrophenyl)-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STK551431
SMILES CCOc1cc(/C=N/NC(=O)c2nnn(c2c2cccc(c2)[N+](=O)[O-])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 C26H19N11O10 MW 645.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19N11O10/c1-2-45-21-10-14(6-8-20(21)46-19-9-7-17(36(41)42)12-18(19)37(43)44)13-28-30-26(38)22-23(15-4-3-5-16(11-15)35(39)40)34(33-29-22)25-24(27)31-47-32-25/h3-13H,2H2,1H3,(H2,27,31)(H,30,38)/b28-13+InChIKey
FWJZZIBEJBCKGH-XODNFHPESA-NSynonyms
(E)1(4amino125oxadiazol3yl)N(4(24dinitrophenoxy)3ethoxybenzylidene)5(3nitrophenyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(4(24dinitrophenoxy)3ethoxyphenyl)methylidene)5(3nitrophenyl)1H123triazole4carbohydrazide
CCOC1=C(C=CC(=C1)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)C4=CC(=CC=C4)(N+)(=O)(O))OC5=C(C=C(C=C5)(N+)(=O)(O))(N+)(=O)(O)
CCOc1cc(C=NNC(=O)c2nnn(c2c2cccc(c2)(N+)(=O)(O))c2nonc2N)ccc1Oc1ccc(cc1(N+)(=O)(O))(N+)(=O)(O)
InChI=1SC26H19N11O10c1245211014(6820(21)46199717(36(41)42)1218(19)37(43)44)13283026(38)2223(1543516(1115)35(39)40)34(332922)2524(27)31473225h313H2H21H3(H22731)(H3038)b2813+
MFCD03339096
ZINC000195779518
ZINC195779516
Check stock
See real-time availability and sample size for STK551431 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.