Vitas-M small molecule compound
(2E)-N-[1-(2-chloro-6-fluorobenzyl)-3,5-dimethyl-1H-pyrazol-4-yl]-3-(4-methoxyphenyl)prop-2-enamide
Catalog ID
STK452227
SMILES COc1ccc(cc1)/C=C/C(=O)Nc1c(C)nn(c1C)Cc1c(F)cccc1Cl
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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 C22H21ClFN3O2 MW 413.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClFN3O2/c1-14-22(25-21(28)12-9-16-7-10-17(29-3)11-8-16)15(2)27(26-14)13-18-19(23)5-4-6-20(18)24/h4-12H,13H2,1-3H3,(H,25,28)/b12-9+InChIKey
LJXFZUKQUVZCFF-FMIVXFBMSA-NSynonyms
(2E)N(1((6CHLORO2FLUOROPHENYL)METHYL)35DIMETHYLPYRAZOL4YL)3(4METHOXYPHENYL)PROP2ENAMIDE
(2E)N(1(2chloro6fluorobenzyl)35dimethyl1Hpyrazol4yl)3(4methoxyphenyl)prop2enamide
(E)N(1((2CHLORO6FLUOROPHENYL)METHYL)35DIMETHYLPYRAZOL4YL)3(4METHOXYPHENYL)PROP2ENAMIDE
CC1=C(C(=NN1CC2=C(C=CC=C2Cl)F)C)NC(=O)C=CC3=CC=C(C=C3)OC
COc1ccc(cc1)C=CC(=O)Nc1c(C)nn(c1C)Cc1c(F)cccc1Cl
InChI=1SC22H21ClFN3O2c11422(2521(28)1291671017(293)11816)15(2)27(2614)131819(23)54620(18)24h412H13H213H3(H2528)b129+
MFCD03071588
ZINC000000680061
ZINC00680061
ZINC680061
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