Vitas-M small molecule compound
(2E)-N-benzyl-3-(3-{4-[(2-chlorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)-2-cyanoprop-2-enamide
Catalog ID
STK810323
SMILES N#C/C(=C\c1cn(nc1c1ccc(cc1)OCc1ccccc1Cl)c1ccccc1)/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 C33H25ClN4O2 MW 545.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H25ClN4O2/c34-31-14-8-7-11-26(31)23-40-30-17-15-25(16-18-30)32-28(22-38(37-32)29-12-5-2-6-13-29)19-27(20-35)33(39)36-21-24-9-3-1-4-10-24/h1-19,22H,21,23H2,(H,36,39)/b27-19+InChIKey
ZEVYXOGYDKZVGJ-ZXVVBBHZSA-NSynonyms
(2E)Nbenzyl3(3(4((2chlorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)2cyanoprop2enamide
(E)NBENZYL3(3(4((2CHLOROPHENYL)METHOXY)PHENYL)1PHENYLPYRAZOL4YL)2CYANOPROP2ENAMIDE
C1=CC=C(C=C1)CNC(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)OCC4=CC=CC=C4Cl)C5=CC=CC=C5)C#N
InChI=1SC33H25ClN4O2c343114871126(31)234030171525(161830)3228(2238(3732)29125261329)1927(2035)33(39)36212493141024h11922H2123H2(H3639)b2719+
MFCD04549638
N#CC(=Cc1cn(nc1c1ccc(cc1)OCc1ccccc1Cl)c1ccccc1)C(=O)NCc1ccccc1
ZINC000002672394
ZINC2672394
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