Vitas-M small molecule compound

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

Catalog ID
STK548467
SMILES Fc1ccc(cc1)COc1cccc(c1)/C=N/NC(=O)c1nnn(c1c1ccccc1)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 C25H19FN8O3 MW 498.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19FN8O3/c26-19-11-9-16(10-12-19)15-36-20-8-4-5-17(13-20)14-28-30-25(35)21-22(18-6-2-1-3-7-18)34(33-29-21)24-23(27)31-37-32-24/h1-14H,15H2,(H2,27,31)(H,30,35)/b28-14+
InChIKey
PYXNMUYDYYFCKB-CCVNUDIWSA-N
Synonyms
488135-06-4
(E)1(4amino125oxadiazol3yl)N(3((4fluorobenzyl)oxy)benzylidene)5phenyl1H123triazole4carbohydrazide
1(4amino125oxadiazol3yl)N((E)(3((4fluorobenzyl)oxy)phenyl)methylidene)5phenyl1H123triazole4carbohydrazide
1(4AMINO125OXADIAZOL3YL)N((E)(3((4FLUOROPHENYL)METHOXY)PHENYL)METHYLIDENEAMINO)5PHENYLTRIAZOLE4CARBOXAMIDE
488135064
C1=CC=C(C=C1)C2=C(N=NN2C3=NON=C3N)C(=O)NN=CC4=CC(=CC=C4)OCC5=CC=C(C=C5)F
Fc1ccc(cc1)COc1cccc(c1)C=NNC(=O)c1nnn(c1c1ccccc1)c1nonc1N
InChI=1SC25H19FN8O3c261911916(101219)15362084517(1320)14283025(35)2122(186213718)34(332921)2423(27)31373224h114H15H2(H22731)(H3035)b2814+
MFCD03290137
ZINC000002332231
ZINC33361276

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.