Vitas-M small molecule compound
(2Z)-3-(3-{3-[(4-chlorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)-2-(4-oxo-3,4-dihydroquinazolin-2-yl)prop-2-enenitrile
Catalog ID
STK706829
SMILES N#C/C(=C/c1cn(nc1c1cccc(c1)OCc1ccc(cc1)Cl)c1ccccc1)/c1nc2ccccc2c(=O)[nH]1
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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 C33H22ClN5O2 MW 556.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H22ClN5O2/c34-26-15-13-22(14-16-26)21-41-28-10-6-7-23(18-28)31-25(20-39(38-31)27-8-2-1-3-9-27)17-24(19-35)32-36-30-12-5-4-11-29(30)33(40)37-32/h1-18,20H,21H2,(H,36,37,40)/b24-17-InChIKey
JFLDSAYGOGSCED-ULJHMMPZSA-NSynonyms
(2Z)3(3(3((4chlorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)2(4oxo34dihydroquinazolin2yl)prop2enenitrile
(E)3(3(3((4chlorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)2(4oxo34dihydroquinazolin2yl)acrylonitrile
(Z)3(3(3((4chlorophenyl)methoxy)phenyl)1phenylpyrazol4yl)2(4oxo1Hquinazolin2yl)prop2enenitrile
C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)OCC4=CC=C(C=C4)Cl)C=C(C#N)C5=NC(=O)C6=CC=CC=C6N5
InChI=1SC33H22ClN5O2c3426151322(141626)214128106723(1828)3125(2039(3831)278213927)1724(1935)32363012541129(30)33(40)3732h11820H21H2(H363740)b2417
MFCD13371151
N#CC(=Cc1cn(nc1c1cccc(c1)OCc1ccc(cc1)Cl)c1ccccc1)c1nc2ccccc2c(=O)(nH)1
ZINC000097947243
ZINC97947243
Check stock
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