Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-[1-(3,4-dimethylphenyl)ethyl]prop-2-enamide
Catalog ID
STK422853
SMILES N#C/C(=C\c1ccc2c(c1)OCO2)/C(=O)NC(c1ccc(c(c1)C)C)C
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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 C21H20N2O3 MW 348.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N2O3/c1-13-4-6-17(8-14(13)2)15(3)23-21(24)18(11-22)9-16-5-7-19-20(10-16)26-12-25-19/h4-10,15H,12H2,1-3H3,(H,23,24)/b18-9+InChIKey
XLPJXBBZANCYGB-GIJQJNRQSA-NSynonyms
(2E)3(13benzodioxol5yl)2cyanoN(1(34dimethylphenyl)ethyl)prop2enamide
(2E)3(2HBENZO(34D)13DIOXOLEN5YL)N((34DIMETHYLPHENYL)ETHYL)2CYANOPROP2ENAMIDE
(E)3(13BENZODIOXOL5YL)2CYANON(1(34DIMETHYLPHENYL)ETHYL)PROP2ENAMIDE
3(13BENZODIOXOL5YL)2CYANON(1(34DIMETHYLPHENYL)ETHYL)ACRYLAMIDE
CC1=C(C=C(C=C1)C(C)NC(=O)C(=CC2=CC3=C(C=C2)OCO3)C#N)C
InChI=1SC21H20N2O3c1134617(814(13)2)15(3)2321(24)18(1122)916571920(1016)26122519h41015H12H213H3(H2324)b189+
MFCD02177289
N#CC(=Cc1ccc2c(c1)OCO2)C(=O)NC(c1ccc(c(c1)C)C)C
ZINC000000370504
ZINC000000370506
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