Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(E)-(4-butoxyphenyl)methylidene]-4-methyl-1H-1,2,3-triazole-5-carbohydrazide
Catalog ID
STK752005
SMILES CCCCOc1ccc(cc1)/C=N/NC(=O)c1c(C)nnn1c1nonc1N
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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 C17H20N8O3 MW 384.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H20N8O3/c1-3-4-9-27-13-7-5-12(6-8-13)10-19-21-17(26)14-11(2)20-24-25(14)16-15(18)22-28-23-16/h5-8,10H,3-4,9H2,1-2H3,(H2,18,22)(H,21,26)/b19-10+InChIKey
MDBWQAKOIGTKRF-VXLYETTFSA-NSynonyms
1(4amino125oxadiazol3yl)N((E)(4butoxyphenyl)methylidene)4methyl1H123triazole5carbohydrazide
3(4AMINO125OXADIAZOL3YL)N((E)(4BUTOXYPHENYL)METHYLIDENEAMINO)5METHYLTRIAZOLE4CARBOXAMIDE
CCCCOC1=CC=C(C=C1)C=NNC(=O)C2=C(N=NN2C3=NON=C3N)C
CCCCOc1ccc(cc1)C=NNC(=O)c1c(C)nnn1c1nonc1N
InChI=1SC17H20N8O3c134927137512(6813)10192117(26)1411(2)202425(14)1615(18)22282316h5810H349H212H3(H21822)(H2126)b1910+
MFCD00748025
ZINC000001953877
ZINC33346741
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