Vitas-M small molecule compound
(2Z)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-(3,5-dimethylphenyl)prop-2-enamide
Catalog ID
STK378498
SMILES N#C/C(=C/c1ccc2c(c1)OCO2)/C(=O)Nc1cc(C)cc(c1)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 C19H16N2O3 MW 320.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16N2O3/c1-12-5-13(2)7-16(6-12)21-19(22)15(10-20)8-14-3-4-17-18(9-14)24-11-23-17/h3-9H,11H2,1-2H3,(H,21,22)/b15-8-InChIKey
PQMRDMHFAUDQDK-NVNXTCNLSA-NSynonyms
(2Z)3(13benzodioxol5yl)2cyanoN(35dimethylphenyl)prop2enamide
(Z)3(13BENZODIOXOL5YL)2CYANON(35DIMETHYLPHENYL)PROP2ENAMIDE
3(2HBENZO(34D)13DIOXOLAN5YL)(2Z)N(35DIMETHYLPHENYL)2CYANOPROP2ENAMIDE
CC1=CC(=CC(=C1)NC(=O)C(=CC2=CC3=C(C=C2)OCO3)C#N)C
InChI=1SC19H16N2O3c112513(2)716(612)2119(22)15(1020)814341718(914)24112317h39H11H212H3(H2122)b158
MFCD01787431
N#CC(=Cc1ccc2c(c1)OCO2)C(=O)Nc1cc(C)cc(c1)C
ZINC000004502027
ZINC04502027
ZINC4502027
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