Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[cyclohexyl(methyl)amino]methyl}-N'-[(E)-(4-methoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL348093
SMILES COc1ccc(cc1)/C=N/NC(=O)c1nnn(c1CN(C1CCCCC1)C)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 C21H27N9O3 MW 453.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N9O3/c1-29(15-6-4-3-5-7-15)13-17-18(24-28-30(17)20-19(22)26-33-27-20)21(31)25-23-12-14-8-10-16(32-2)11-9-14/h8-12,15H,3-7,13H2,1-2H3,(H2,22,26)(H,25,31)/b23-12+InChIKey
FGNPULXVTSLDQS-FSJBWODESA-NSynonyms
861640-30-4(E)1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N(4methoxybenzylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N((E)(4methoxyphenyl)methylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5((cyclohexyl(methyl)amino)methyl)N((E)(4methoxyphenyl)methylideneamino)triazole4carboxamide
861640304
CN(CC1=C(N=NN1C2=NON=C2N)C(=O)NN=CC3=CC=C(C=C3)OC)C4CCCCC4
InChI=1SC21H27N9O3c129(156435715)131718(242830(17)2019(22)26332720)21(31)2523121481016(322)11914h81215H3713H212H3(H22226)(H2531)b2312+
MFCD05685872
ZINC000013805003
ZINC34849055
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