Vitas-M small molecule compound
(2E)-3-[3-chloro-5-ethoxy-4-(prop-2-yn-1-yloxy)phenyl]-2-cyano-N-cyclopentylprop-2-enamide
Catalog ID
STK042110
SMILES C#CCOc1c(Cl)cc(cc1OCC)/C=C(/C(=O)NC1CCCC1)\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 C20H21ClN2O3 MW 372.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClN2O3/c1-3-9-26-19-17(21)11-14(12-18(19)25-4-2)10-15(13-22)20(24)23-16-7-5-6-8-16/h1,10-12,16H,4-9H2,2H3,(H,23,24)/b15-10+InChIKey
JNKUOCWACCRYJY-XNTDXEJSSA-NSynonyms
(2E)3(3CHLORO5ETHOXY4(PROP2YN1YLOXY)PHENYL)2CYANONCYCLOPENTYLPROP2ENAMIDE
(E)3(3CHLORO5ETHOXY4PROP2YNOXYPHENYL)2CYANONCYCLOPENTYLPROP2ENAMIDE
C#CCOc1c(Cl)cc(cc1OCC)C=C(C(=O)NC1CCCC1)C#N
CCOC1=C(C(=CC(=C1)C=C(C#N)C(=O)NC2CCCC2)Cl)OCC#C
InChI=1SC20H21ClN2O3c139261917(21)1114(1218(19)2542)1015(1322)20(24)2316756816h1101216H49H22H3(H2324)b1510+
MFCD08050723
STK042110
ZINC000004616808
ZINC04616808
ZINC4616808
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