Vitas-M small molecule compound
(2E)-3-{3-[(2-chlorobenzyl)oxy]phenyl}-2-cyano-N-(3,4-dimethylphenyl)prop-2-enamide
Catalog ID
STL383478
SMILES N#C/C(=C\c1cccc(c1)OCc1ccccc1Cl)/C(=O)Nc1ccc(c(c1)C)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 C25H21ClN2O2 MW 416.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClN2O2/c1-17-10-11-22(12-18(17)2)28-25(29)21(15-27)13-19-6-5-8-23(14-19)30-16-20-7-3-4-9-24(20)26/h3-14H,16H2,1-2H3,(H,28,29)/b21-13+InChIKey
QLXMRZNBMZCBMB-FYJGNVAPSA-NSynonyms
(2E)3(3((2chlorobenzyl)oxy)phenyl)2cyanoN(34dimethylphenyl)prop2enamide
(E)3(3((2CHLOROPHENYL)METHOXY)PHENYL)2CYANON(34DIMETHYLPHENYL)PROP2ENAMIDE
CC1=C(C=C(C=C1)NC(=O)C(=CC2=CC(=CC=C2)OCC3=CC=CC=C3Cl)C#N)C
InChI=1SC25H21ClN2O2c117101122(1218(17)2)2825(29)21(1527)131965823(1419)301620734924(20)26h314H16H212H3(H2829)b2113+
MFCD03478405
N#CC(=Cc1cccc(c1)OCc1ccccc1Cl)C(=O)Nc1ccc(c(c1)C)C
ZINC000004966329
ZINC04966329
ZINC4966329
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