Vitas-M small molecule compound
(2E)-3-(3-{4-[(2-chlorobenzyl)oxy]phenyl}-1-phenyl-1H-pyrazol-4-yl)-2-cyano-N-(1-phenylethyl)prop-2-enamide
Catalog ID
STK810577
SMILES N#C/C(=C\c1cn(nc1c1ccc(cc1)OCc1ccccc1Cl)c1ccccc1)/C(=O)NC(c1ccccc1)C
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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 C34H27ClN4O2 MW 559.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H27ClN4O2/c1-24(25-10-4-2-5-11-25)37-34(40)28(21-36)20-29-22-39(30-13-6-3-7-14-30)38-33(29)26-16-18-31(19-17-26)41-23-27-12-8-9-15-32(27)35/h2-20,22,24H,23H2,1H3,(H,37,40)/b28-20+InChIKey
GFXPVGOKYMZPFW-VFCFBJKWSA-NSynonyms
(2E)3(3(4((2chlorobenzyl)oxy)phenyl)1phenyl1Hpyrazol4yl)2cyanoN(1phenylethyl)prop2enamide
(E)3(3(4((2CHLOROPHENYL)METHOXY)PHENYL)1PHENYLPYRAZOL4YL)2CYANON(1PHENYLETHYL)PROP2ENAMIDE
CC(C1=CC=CC=C1)NC(=O)C(=CC2=CN(N=C2C3=CC=C(C=C3)OCC4=CC=CC=C4Cl)C5=CC=CC=C5)C#N
InChI=1SC34H27ClN4O2c124(25104251125)3734(40)28(2136)20292239(30136371430)3833(29)26161831(191726)41232712891532(27)35h2202224H23H21H3(H3740)b2820+
MFCD04550340
N#CC(=Cc1cn(nc1c1ccc(cc1)OCc1ccccc1Cl)c1ccccc1)C(=O)NC(c1ccccc1)C
ZINC000002672747
ZINC000002672749
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