Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-N'-[(E)-(4-methylphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL347392
SMILES CN(C1CCCCC1)Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)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 C21H27N9O2 MW 437.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N9O2/c1-14-8-10-15(11-9-14)12-23-25-21(31)18-17(13-29(2)16-6-4-3-5-7-16)30(28-24-18)20-19(22)26-32-27-20/h8-12,16H,3-7,13H2,1-2H3,(H2,22,26)(H,25,31)/b23-12+InChIKey
MFLPABPEUBIPNI-FSJBWODESA-NSynonyms
849034-53-3(E)1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N(4methylbenzylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N((E)(4methylphenyl)methylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N((E)(4methylphenyl)methylideneamino)triazole4carboxamide
849034533
CC1=CC=C(C=C1)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)CN(C)C4CCCCC4
CN(C1CCCCC1)Cc1c(nnn1c1nonc1N)C(=O)NN=Cc1ccc(cc1)C
InChI=1SC21H27N9O2c11481015(11914)12232521(31)1817(1329(2)166435716)30(282418)2019(22)26322720h81216H3713H212H3(H22226)(H2531)b2312+
MFCD05682260
ZINC000009307163
ZINC34846702
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