Vitas-M small molecule compound
(2Z)-2-cyano-3-[3-(3-fluoro-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-N-(tetrahydrofuran-2-ylmethyl)prop-2-enamide
Catalog ID
STK704275
SMILES N#C/C(=C/c1cn(nc1c1ccc(c(c1)F)OC)c1ccccc1)/C(=O)NCC1CCCO1
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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 C25H23FN4O3 MW 446.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23FN4O3/c1-32-23-10-9-17(13-22(23)26)24-19(16-30(29-24)20-6-3-2-4-7-20)12-18(14-27)25(31)28-15-21-8-5-11-33-21/h2-4,6-7,9-10,12-13,16,21H,5,8,11,15H2,1H3,(H,28,31)/b18-12-InChIKey
XBWFSYPYAFZTQD-PDGQHHTCSA-NSynonyms
(2Z)2cyano3(3(3fluoro4methoxyphenyl)1phenyl1Hpyrazol4yl)N(tetrahydrofuran2ylmethyl)prop2enamide
(Z)2CYANO3(3(3FLUORO4METHOXYPHENYL)1PHENYLPYRAZOL4YL)N(OXOLAN2YLMETHYL)PROP2ENAMIDE
COC1=C(C=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NCC3CCCO3)C4=CC=CC=C4)F
InChI=1SC25H23FN4O3c1322310917(1322(23)26)2419(1630(2924)206324720)1218(1427)25(31)28152185113321h246791012131621H581115H21H3(H2831)b1812
MFCD03506605
N#CC(=Cc1cn(nc1c1ccc(c(c1)F)OC)c1ccccc1)C(=O)NCC1CCCO1
ZINC000015227836
ZINC000015227837
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