Vitas-M small molecule compound
(2E)-N-(3-chloro-4-methylphenyl)-2-cyano-3-[3-ethoxy-4-(prop-2-yn-1-yloxy)phenyl]prop-2-enamide
Catalog ID
STK185237
SMILES CCOc1cc(ccc1OCC#C)/C=C(/C(=O)Nc1ccc(c(c1)Cl)C)\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 C22H19ClN2O3 MW 394.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN2O3/c1-4-10-28-20-9-7-16(12-21(20)27-5-2)11-17(14-24)22(26)25-18-8-6-15(3)19(23)13-18/h1,6-9,11-13H,5,10H2,2-3H3,(H,25,26)/b17-11+InChIKey
WVEJMVAPTYLSJR-GZTJUZNOSA-NSynonyms
(2E)N(3CHLORO4METHYLPHENYL)2CYANO3(3ETHOXY4(PROP2YN1YLOXY)PHENYL)PROP2ENAMIDE
(E)N(3CHLORO4METHYLPHENYL)2CYANO3(3ETHOXY4PROP2YNOXYPHENYL)PROP2ENAMIDE
CCOC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC(=C(C=C2)C)Cl)OCC#C
CCOc1cc(ccc1OCC#C)C=C(C(=O)Nc1ccc(c(c1)Cl)C)C#N
InChI=1SC22H19ClN2O3c141028209716(1221(20)2752)1117(1424)22(26)25188615(3)19(23)1318h1691113H510H223H3(H2526)b1711+
MFCD03729367
ZINC000004723463
ZINC04723463
ZINC4723463
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