Vitas-M small molecule compound
(2E)-N-(3-chloro-2-methylphenyl)-2-cyano-3-[4-(piperidin-1-yl)phenyl]prop-2-enamide
Catalog ID
STK059372
SMILES N#C/C(=C\c1ccc(cc1)N1CCCCC1)/C(=O)Nc1cccc(c1C)Cl
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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 C22H22ClN3O MW 379.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN3O/c1-16-20(23)6-5-7-21(16)25-22(27)18(15-24)14-17-8-10-19(11-9-17)26-12-3-2-4-13-26/h5-11,14H,2-4,12-13H2,1H3,(H,25,27)/b18-14+InChIKey
ZFNLRQSGVJNBCC-NBVRZTHBSA-NSynonyms
(2E)N(3CHLORO2METHYLPHENYL)2CYANO3(4(PIPERIDIN1YL)PHENYL)PROP2ENAMIDE
(E)N(3CHLORO2METHYLPHENYL)2CYANO3(4PIPERIDIN1YLPHENYL)PROP2ENAMIDE
CC1=C(C=CC=C1Cl)NC(=O)C(=CC2=CC=C(C=C2)N3CCCCC3)C#N
InChI=1SC22H22ClN3Oc11620(23)65721(16)2522(27)18(1524)141781019(11917)26123241326h51114H241213H21H3(H2527)b1814+
MFCD03244342
N#CC(=Cc1ccc(cc1)N1CCCCC1)C(=O)Nc1cccc(c1C)Cl
STK059372
ZINC000005881685
ZINC05881685
ZINC5881685
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