Vitas-M small molecule compound
(2Z)-N-benzyl-2-cyano-3-[3-(3,4-dimethoxyphenyl)-1H-pyrazol-4-yl]prop-2-enamide
Catalog ID
STK422690
SMILES N#C/C(=C/c1c[nH]nc1c1ccc(c(c1)OC)OC)/C(=O)NCc1ccccc1
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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 C22H20N4O3 MW 388.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O3/c1-28-19-9-8-16(11-20(19)29-2)21-18(14-25-26-21)10-17(12-23)22(27)24-13-15-6-4-3-5-7-15/h3-11,14H,13H2,1-2H3,(H,24,27)(H,25,26)/b17-10-InChIKey
FYRKVSWZKMCWIQ-YVLHZVERSA-NSynonyms
(2Z)3(3(34DIMETHOXYPHENYL)PYRAZOL4YL)2CYANONBENZYLPROP2ENAMIDE
(2Z)Nbenzyl2cyano3(3(34dimethoxyphenyl)1Hpyrazol4yl)prop2enamide
(Z)NBENZYL2CYANO3(5(34DIMETHOXYPHENYL)1HPYRAZOL4YL)PROP2ENAMIDE
COC1=C(C=C(C=C1)C2=C(C=NN2)C=C(C#N)C(=O)NCC3=CC=CC=C3)OC
InChI=1SC22H20N4O3c128199816(1120(19)292)2118(14252621)1017(1223)22(27)2413156435715h31114H13H212H3(H2427)(H2526)b1710
MFCD02176171
N#CC(=Cc1c(nH)nc1c1ccc(c(c1)OC)OC)C(=O)NCc1ccccc1
ZINC000005728360
ZINC05728360
ZINC5728360
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