Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-N'-[(E)-(4-propoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL005337
SMILES CCCOc1ccc(cc1)/C=N/NC(=O)c1nnn(c1c1ccc2c(c1)OCO2)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 C22H20N8O5 MW 476.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N8O5/c1-2-9-32-15-6-3-13(4-7-15)11-24-26-22(31)18-19(14-5-8-16-17(10-14)34-12-33-16)30(29-25-18)21-20(23)27-35-28-21/h3-8,10-11H,2,9,12H2,1H3,(H2,23,27)(H,26,31)/b24-11+InChIKey
ZJAVDQNCHUBEOB-BHGWPJFGSA-NSynonyms
849030-62-2(E)1(4amino125oxadiazol3yl)5(benzo(d)(13)dioxol5yl)N(4propoxybenzylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(13benzodioxol5yl)N((E)(4propoxyphenyl)methylidene)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)5(13BENZODIOXOL5YL)N((E)(4PROPOXYPHENYL)METHYLIDENEAMINO)TRIAZOLE4CARBOXAMIDE
849030622
CCCOC1=CC=C(C=C1)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)C4=CC5=C(C=C4)OCO5
CCCOc1ccc(cc1)C=NNC(=O)c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1N
InChI=1SC22H20N8O5c12932156313(4715)11242622(31)1819(14581617(1014)34123316)30(292518)2120(23)27352821h381011H2912H21H3(H22327)(H2631)b2411+
MFCD05681848
ZINC000002454179
ZINC33372985
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