Vitas-M small molecule compound
(2E)-3-{4-[(2-chlorobenzyl)oxy]-3-methoxyphenyl}-2-cyano-N-propylprop-2-enamide
Catalog ID
STK041986
SMILES CCCNC(=O)/C(=C/c1ccc(c(c1)OC)OCc1ccccc1Cl)/C#N
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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 C21H21ClN2O3 MW 384.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN2O3/c1-3-10-24-21(25)17(13-23)11-15-8-9-19(20(12-15)26-2)27-14-16-6-4-5-7-18(16)22/h4-9,11-12H,3,10,14H2,1-2H3,(H,24,25)/b17-11+InChIKey
YUNKJVCOBAGNPG-GZTJUZNOSA-NSynonyms
(2E)3(4((2CHLOROBENZYL)OXY)3METHOXYPHENYL)2CYANONPROPYLPROP2ENAMIDE
(E)3(4((2CHLOROPHENYL)METHOXY)3METHOXYPHENYL)2CYANONPROPYLPROP2ENAMIDE
CCCNC(=O)C(=CC1=CC(=C(C=C1)OCC2=CC=CC=C2Cl)OC)C#N
CCCNC(=O)C(=Cc1ccc(c(c1)OC)OCc1ccccc1Cl)C#N
InChI=1SC21H21ClN2O3c13102421(25)17(1323)11158919(20(1215)262)271416645718(16)22h491112H31014H212H3(H2425)b1711+
MFCD03498275
STK041986
ZINC000004616798
ZINC04616798
ZINC4616798
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