Vitas-M small molecule compound
(2Z)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-(4-methylbenzyl)prop-2-enamide
Catalog ID
STK422659
SMILES N#C/C(=C/c1ccc2c(c1)OCO2)/C(=O)NCc1ccc(cc1)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/c1-13-2-4-14(5-3-13)11-21-19(22)16(10-20)8-15-6-7-17-18(9-15)24-12-23-17/h2-9H,11-12H2,1H3,(H,21,22)/b16-8-InChIKey
AEKHOFPIGVVXCX-PXNMLYILSA-NSynonyms
(2Z)3(13benzodioxol5yl)2cyanoN(4methylbenzyl)prop2enamide
(Z)3(13benzodioxol5yl)2cyanoN((4methylphenyl)methyl)prop2enamide
3(2HBENZO(34D)13DIOXOLEN5YL)(2Z)2CYANON((4METHYLPHENYL)METHYL)PROP2ENAMIDE
CC1=CC=C(C=C1)CNC(=O)C(=CC2=CC3=C(C=C2)OCO3)C#N
InChI=1SC19H16N2O3c1132414(5313)112119(22)16(1020)815671718(915)24122317h29H1112H21H3(H2122)b168
MFCD02176492
N#CC(=Cc1ccc2c(c1)OCO2)C(=O)NCc1ccc(cc1)C
ZINC000006211867
ZINC06211867
ZINC6211867
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