Vitas-M small molecule compound

1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(3-methoxyphenyl)-N'-{(E)-[3-(trifluoromethyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide

Catalog ID
STL348466
SMILES COc1cccc(c1)c1c(nnn1c1nonc1N)C(=O)N/N=C/c1cccc(c1)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 C20H15F3N8O3 MW 472.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15F3N8O3/c1-33-14-7-3-5-12(9-14)16-15(26-30-31(16)18-17(24)28-34-29-18)19(32)27-25-10-11-4-2-6-13(8-11)20(21,22)23/h2-10H,1H3,(H2,24,28)(H,27,32)/b25-10+
InChIKey
ZHJPTBSSFQACPZ-KIBLKLHPSA-N
Synonyms
862184-72-3
(E)1(4amino125oxadiazol3yl)5(3methoxyphenyl)N(3(trifluoromethyl)benzylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(3methoxyphenyl)N((E)(3(trifluoromethyl)phenyl)methylidene)1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)5(3methoxyphenyl)N((E)(3(trifluoromethyl)phenyl)methylideneamino)triazole4carboxamide
862184723
COC1=CC=CC(=C1)C2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=CC(=CC=C4)C(F)(F)F
COc1cccc(c1)c1c(nnn1c1nonc1N)C(=O)NN=Cc1cccc(c1)C(F)(F)F
InChI=1SC20H15F3N8O3c1331473512(914)1615(263031(16)1817(24)28342918)19(32)2725101142613(811)20(2122)23h210H1H3(H22428)(H2732)b2510+
MFCD05687835
ZINC000009499359
ZINC33404957

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Available files

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