Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-[(1E)-1-(1,3-benzodioxol-5-yl)ethylidene]-5-(4-propoxyphenyl)-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL003959
SMILES CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)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 C23H22N8O5 MW 490.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22N8O5/c1-3-10-33-16-7-4-14(5-8-16)20-19(26-30-31(20)22-21(24)28-36-29-22)23(32)27-25-13(2)15-6-9-17-18(11-15)35-12-34-17/h4-9,11H,3,10,12H2,1-2H3,(H2,24,28)(H,27,32)/b25-13+InChIKey
JZFVREZQSBNGIK-DHRITJCHSA-NSynonyms
850745-82-3(E)1(4amino125oxadiazol3yl)N(1(benzo(d)(13)dioxol5yl)ethylidene)5(4propoxyphenyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((1E)1(13benzodioxol5yl)ethylidene)5(4propoxyphenyl)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)1(13benzodioxol5yl)ethylideneamino)5(4propoxyphenyl)triazole4carboxamide
850745823
CCCOC1=CC=C(C=C1)C2=C(N=NN2C3=NON=C3N)C(=O)NN=C(C)C4=CC5=C(C=C4)OCO5
CCCOc1ccc(cc1)c1c(nnn1c1nonc1N)C(=O)NN=C(c1ccc2c(c1)OCO2)C
InChI=1SC23H22N8O5c131033167414(5816)2019(263031(20)2221(24)28362922)23(32)272513(2)15691718(1115)35123417h4911H31012H212H3(H22428)(H2732)b2513+
MFCD05693892
ZINC000009291025
ZINC97494981
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