Vitas-M small molecule compound
(2E)-N-(1,3-benzodioxol-5-yl)-2-cyano-3-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)prop-2-enamide
Catalog ID
STK461224
SMILES N#C/C(=C\c1c(C)nn(c1C)CC)/C(=O)Nc1ccc2c(c1)OCO2
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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 C18H18N4O3 MW 338.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H18N4O3/c1-4-22-12(3)15(11(2)21-22)7-13(9-19)18(23)20-14-5-6-16-17(8-14)25-10-24-16/h5-8H,4,10H2,1-3H3,(H,20,23)/b13-7+InChIKey
BDHBROSVMHSCSS-NTUHNPAUSA-NSynonyms
(2E)N(13benzodioxol5yl)2cyano3(1ethyl35dimethyl1Hpyrazol4yl)prop2enamide
(2E)N(2HBENZO(D)13DIOXOLAN5YL)2CYANO3(1ETHYL35DIMETHYLPYRAZOL4YL)PROP2ENAMIDE
(E)N(13benzodioxol5yl)2cyano3(1ethyl35dimethylpyrazol4yl)prop2enamide
CCN1C(=C(C(=N1)C)C=C(C#N)C(=O)NC2=CC3=C(C=C2)OCO3)C
InChI=1SC18H18N4O3c142212(3)15(11(2)2122)713(919)18(23)2014561617(814)25102416h58H410H213H3(H2023)b137+
MFCD04251655
N#CC(=Cc1c(C)nn(c1C)CC)C(=O)Nc1ccc2c(c1)OCO2
ZINC000006961173
ZINC06961173
ZINC6961173
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