Vitas-M small molecule compound
(2Z)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-(3-methylphenyl)prop-2-enamide
Catalog ID
STK186328
SMILES N#C/C(=C/c1ccc2c(c1)OCO2)/C(=O)Nc1cccc(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 C18H14N2O3 MW 306.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H14N2O3/c1-12-3-2-4-15(7-12)20-18(21)14(10-19)8-13-5-6-16-17(9-13)23-11-22-16/h2-9H,11H2,1H3,(H,20,21)/b14-8-InChIKey
HXUAUPUKCXOWNM-ZSOIEALJSA-NSynonyms
5740-46-5(2Z)3(13BENZODIOXOL5YL)2CYANON(3METHYLPHENYL)PROP2ENAMIDE
(Z)3(13BENZODIOXOL5YL)2CYANON(3METHYLPHENYL)PROP2ENAMIDE
3(2HBENZO(34D)13DIOXOLAN5YL)(2Z)2CYANON(3METHYLPHENYL)PROP2ENAMIDE
5740465
CC1=CC(=CC=C1)NC(=O)C(=CC2=CC3=C(C=C2)OCO3)C#N
InChI=1SC18H14N2O3c11232415(712)2018(21)14(1019)813561617(913)23112216h29H11H21H3(H2021)b148
MFCD02051784
N#CC(=Cc1ccc2c(c1)OCO2)C(=O)Nc1cccc(c1)C
ZINC000004499359
ZINC04499359
ZINC4499359
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