Vitas-M small molecule compound
(2E)-3-(3-{3-[(2-fluorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)-2-(4-hydroxyquinazolin-2-yl)prop-2-enenitrile
Catalog ID
STK562208
SMILES N#C/C(=C\c1cn(nc1c1cccc(c1)OCc1ccccc1F)c1ccccc1)/c1nc(O)c2c(n1)cccc2
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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 C33H22FN5O2 MW 539.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H22FN5O2/c34-29-15-6-4-9-23(29)21-41-27-13-8-10-22(18-27)31-25(20-39(38-31)26-11-2-1-3-12-26)17-24(19-35)32-36-30-16-7-5-14-28(30)33(40)37-32/h1-18,20H,21H2,(H,36,37,40)/b24-17+InChIKey
VKAOYDZOTGQMSM-JJIBRWJFSA-NSynonyms
1009442-00-5(2E)3(3(3((2fluorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)2(4hydroxyquinazolin2yl)prop2enenitrile
(E)3(3(3((2FLUOROPHENYL)METHOXY)PHENYL)1PHENYLPYRAZOL4YL)2(4OXO1HQUINAZOLIN2YL)PROP2ENENITRILE
C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC(=CC=C3)OCC4=CC=CC=C4F)C=C(C#N)C5=NC(=O)C6=CC=CC=C6N5
InChI=1SC33H22FN5O2c34291564923(29)2141271381022(1827)3125(2039(3831)26112131226)1724(1935)32363016751428(30)33(40)3732h11820H21H2(H363740)b2417+
MFCD04074300
N#CC(=Cc1cn(nc1c1cccc(c1)OCc1ccccc1F)c1ccccc1)c1nc(O)c2c(n1)cccc2
ZINC000097966940
ZINC97966940
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