Vitas-M small molecule compound
(2E)-2-cyano-3-[3-(3,4-dimethoxyphenyl)-1-(2-fluorobenzyl)-1H-pyrazol-4-yl]-N-(pyridin-2-ylmethyl)prop-2-enamide
Catalog ID
STK467055
SMILES N#C/C(=C\c1cn(nc1c1ccc(c(c1)OC)OC)Cc1ccccc1F)/C(=O)NCc1ccccn1
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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 C28H24FN5O3 MW 497.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H24FN5O3/c1-36-25-11-10-19(14-26(25)37-2)27-22(18-34(33-27)17-20-7-3-4-9-24(20)29)13-21(15-30)28(35)32-16-23-8-5-6-12-31-23/h3-14,18H,16-17H2,1-2H3,(H,32,35)/b21-13+InChIKey
FRSJFWPBJMPJRE-FYJGNVAPSA-NSynonyms
(2E)2cyano3(3(34dimethoxyphenyl)1(2fluorobenzyl)1Hpyrazol4yl)N(pyridin2ylmethyl)prop2enamide
(2E)3(3(34DIMETHOXYPHENYL)1((2FLUOROPHENYL)METHYL)PYRAZOL4YL)2CYANON(2PYRIDYLMETHYL)PROP2ENAMIDE
(E)2cyano3(3(34dimethoxyphenyl)1((2fluorophenyl)methyl)pyrazol4yl)N(pyridin2ylmethyl)prop2enamide
COC1=C(C=C(C=C1)C2=NN(C=C2C=C(C#N)C(=O)NCC3=CC=CC=N3)CC4=CC=CC=C4F)OC
InChI=1SC28H24FN5O3c13625111019(1426(25)372)2722(1834(3327)1720734924(20)29)1321(1530)28(35)321623856123123h31418H1617H212H3(H3235)b2113+
MFCD06114346
N#CC(=Cc1cn(nc1c1ccc(c(c1)OC)OC)Cc1ccccc1F)C(=O)NCc1ccccn1
ZINC000020259271
ZINC20259271
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