Vitas-M small molecule compound
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-ethoxyphenyl)-N'-{(E)-[4-(trifluoromethyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Catalog ID
STL348858
SMILES CCOc1cccc(c1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1ccc(cc1)C(F)(F)F
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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 C21H17F3N8O3 MW 486.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17F3N8O3/c1-2-34-15-5-3-4-13(10-15)17-16(27-31-32(17)19-18(25)29-35-30-19)20(33)28-26-11-12-6-8-14(9-7-12)21(22,23)24/h3-11H,2H2,1H3,(H2,25,29)(H,28,33)/b26-11+InChIKey
VUWNPZKFIPESOE-KBKYJPHKSA-NSynonyms
850749-93-8(E)1(4amino125oxadiazol3yl)5(3ethoxyphenyl)N(4(trifluoromethyl)benzylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(3ethoxyphenyl)N((E)(4(trifluoromethyl)phenyl)methylidene)1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)5(3ETHOXYPHENYL)N((E)(4(TRIFLUOROMETHYL)PHENYL)METHYLIDENEAMINO)TRIAZOLE4CARBOXAMIDE
850749938
CCOC1=CC=CC(=C1)C2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=CC=C(C=C4)C(F)(F)F
CCOc1cccc(c1)c1c(nnn1c1nonc1N)C(=O)NN=Cc1ccc(cc1)C(F)(F)F
InChI=1SC21H17F3N8O3c12341553413(1015)1716(273132(17)1918(25)29353019)20(33)282611126814(9712)21(2223)24h311H2H21H3(H22529)(H2833)b2611+
MFCD05694607
ZINC000002419631
ZINC33367789
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