Vitas-M small molecule compound
{[3-(3,4-dimethoxyphenyl)-1-(2-fluorobenzyl)-1H-pyrazol-4-yl]methylidene}propanedinitrile
Catalog ID
STK473353
SMILES N#CC(=Cc1cn(nc1c1ccc(c(c1)OC)OC)Cc1ccccc1F)C#N
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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 C22H17FN4O2 MW 388.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17FN4O2/c1-28-20-8-7-16(10-21(20)29-2)22-18(9-15(11-24)12-25)14-27(26-22)13-17-5-3-4-6-19(17)23/h3-10,14H,13H2,1-2H3InChIKey
ZOBAAMRFUAOZQQ-UHFFFAOYSA-NSynonyms
((3(34DIMETHOXYPHENYL)1((2FLUOROPHENYL)METHYL)PYRAZOL4YL)METHYLENE)METHANE11DICARBONITRILE
((3(34dimethoxyphenyl)1(2fluorobenzyl)1Hpyrazol4yl)methylidene)propanedinitrile
2((3(34dimethoxyphenyl)1((2fluorophenyl)methyl)pyrazol4yl)methylidene)propanedinitrile
COC1=C(C=C(C=C1)C2=NN(C=C2C=C(C#N)C#N)CC3=CC=CC=C3F)OC
InChI=1SC22H17FN4O2c128208716(1021(20)292)2218(915(1124)1225)1427(2622)1317534619(17)23h31014H13H212H3
MFCD07077880
ZINC000017079246
ZINC17079246
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