Vitas-M small molecule compound
(2E)-3-(4-butoxy-3-methoxyphenyl)-2-cyano-N-[3-(trifluoromethyl)phenyl]prop-2-enamide
Catalog ID
STK949920
SMILES CCCCOc1ccc(cc1OC)/C=C(/C(=O)Nc1cccc(c1)C(F)(F)F)\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 C22H21F3N2O3 MW 418.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21F3N2O3/c1-3-4-10-30-19-9-8-15(12-20(19)29-2)11-16(14-26)21(28)27-18-7-5-6-17(13-18)22(23,24)25/h5-9,11-13H,3-4,10H2,1-2H3,(H,27,28)/b16-11+InChIKey
MBSMEPCHABQFDN-LFIBNONCSA-NSynonyms
(2E)3(4butoxy3methoxyphenyl)2cyanoN(3(trifluoromethyl)phenyl)prop2enamide
(E)3(4BUTOXY3METHOXYPHENYL)2CYANON(3(TRIFLUOROMETHYL)PHENYL)PROP2ENAMIDE
CCCCOC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=CC=CC(=C2)C(F)(F)F)OC
CCCCOc1ccc(cc1OC)C=C(C(=O)Nc1cccc(c1)C(F)(F)F)C#N
InChI=1SC22H21F3N2O3c1341030199815(1220(19)292)1116(1426)21(28)271875617(1318)22(2324)25h591113H3410H212H3(H2728)b1611+
MFCD02957057
ZINC000002670457
ZINC02670457
ZINC2670457
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