Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)-N'-[(1E,2E)-2-methyl-3-phenylprop-2-en-1-ylidene]-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL346924
SMILES COc1cccc(c1)c1c(nnn1c1nonc1N)C(=O)N/N=C/C(=C/c1ccccc1)/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 C22H20N8O3 MW 444.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N8O3/c1-14(11-15-7-4-3-5-8-15)13-24-26-22(31)18-19(16-9-6-10-17(12-16)32-2)30(29-25-18)21-20(23)27-33-28-21/h3-13H,1-2H3,(H2,23,27)(H,26,31)/b14-11+,24-13+InChIKey
ACIQJXADZPFFIL-AVHWCGEESA-NSynonyms
849000-57-3(E)1(4amino125oxadiazol3yl)5(3methoxyphenyl)N((E)2methyl3phenylallylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(3methoxyphenyl)N((1E2E)2methyl3phenylprop2en1ylidene)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)5(3METHOXYPHENYL)N((E)((E)2METHYL3PHENYLPROP2ENYLIDENE)AMINO)TRIAZOLE4CARBOXAMIDE
849000573
CC(=CC1=CC=CC=C1)C=NNC(=O)C2=C(N(N=N2)C3=NON=C3N)C4=CC(=CC=C4)OC
COc1cccc(c1)c1c(nnn1c1nonc1N)C(=O)NN=CC(=Cc1ccccc1)C
InChI=1SC22H20N8O3c114(11157435815)13242622(31)1819(16961017(1216)322)30(292518)2120(23)27332821h313H12H3(H22327)(H2631)b1411+2413+
MFCD05679833
ZINC000004465030
ZINC97492678
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