Vitas-M small molecule compound
(2E)-N-(3-chloro-2-methylphenyl)-2-cyano-3-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]prop-2-enamide
Catalog ID
STK185228
SMILES C#CCOc1ccc(cc1OC)/C=C(/C(=O)Nc1cccc(c1C)Cl)\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 C21H17ClN2O3 MW 380.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17ClN2O3/c1-4-10-27-19-9-8-15(12-20(19)26-3)11-16(13-23)21(25)24-18-7-5-6-17(22)14(18)2/h1,5-9,11-12H,10H2,2-3H3,(H,24,25)/b16-11+InChIKey
SZWMYRKBIPDTSI-LFIBNONCSA-NSynonyms
(2E)N(3CHLORO2METHYLPHENYL)2CYANO3(3METHOXY4(PROP2YN1YLOXY)PHENYL)PROP2ENAMIDE
(E)N(3CHLORO2METHYLPHENYL)2CYANO3(3METHOXY4PROP2YNOXYPHENYL)PROP2ENAMIDE
C#CCOc1ccc(cc1OC)C=C(C(=O)Nc1cccc(c1C)Cl)C#N
CC1=C(C=CC=C1Cl)NC(=O)C(=CC2=CC(=C(C=C2)OCC#C)OC)C#N
InChI=1SC21H17ClN2O3c141027199815(1220(19)263)1116(1323)21(25)241875617(22)14(18)2h1591112H10H223H3(H2425)b1611+
MFCD03729357
ZINC000004723462
ZINC04723462
ZINC4723462
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