Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(1,3-benzodioxol-5-yl)ethylidene]-5-{[methyl(phenyl)amino]methyl}-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STK574018
SMILES O=C(c1nnn(c1CN(c1ccccc1)C)c1nonc1N)N/N=C(/c1ccc2c(c1)OCO2)\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 C22H21N9O4 MW 475.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N9O4/c1-13(14-8-9-17-18(10-14)34-12-33-17)24-26-22(32)19-16(11-30(2)15-6-4-3-5-7-15)31(29-25-19)21-20(23)27-35-28-21/h3-10H,11-12H2,1-2H3,(H2,23,27)(H,26,32)/b24-13+InChIKey
XIEOPYZDBOTODW-ZMOGYAJESA-NSynonyms
850764-00-0(E)1(4amino125oxadiazol3yl)N(1(benzo(d)(13)dioxol5yl)ethylidene)5((methyl(phenyl)amino)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((1E)1(13benzodioxol5yl)ethylidene)5((methyl(phenyl)amino)methyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)1(13benzodioxol5yl)ethylideneamino)5((Nmethylanilino)methyl)triazole4carboxamide
850764000
CC(=NNC(=O)C1=C(N(N=N1)C2=NON=C2N)CN(C)C3=CC=CC=C3)C4=CC5=C(C=C4)OCO5
InChI=1SC22H21N9O4c113(14891718(1014)34123317)242622(32)1916(1130(2)156435715)31(292519)2120(23)27352821h310H1112H212H3(H22327)(H2632)b2413+
MFCD05695184
O=C(c1nnn(c1CN(c1ccccc1)C)c1nonc1N)NN=C(c1ccc2c(c1)OCO2)C
ZINC000009291475
ZINC102573632
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.