Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-2-cyano-N-(4-ethylphenyl)prop-2-enamide
Catalog ID
STK180958
SMILES N#C/C(=C\c1ccc2c(c1)OCO2)/C(=O)Nc1ccc(cc1)CC
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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/c1-2-13-3-6-16(7-4-13)21-19(22)15(11-20)9-14-5-8-17-18(10-14)24-12-23-17/h3-10H,2,12H2,1H3,(H,21,22)/b15-9+InChIKey
LUMQKSYMAHCNEM-OQLLNIDSSA-NSynonyms
(2E)3(13BENZODIOXOL5YL)2CYANON(4ETHYLPHENYL)PROP2ENAMIDE
(2E)3(2HBENZO(34D)13DIOXOLEN5YL)2CYANON(4ETHYLPHENYL)PROP2ENAMIDE
(E)3(13BENZODIOXOL5YL)2CYANON(4ETHYLPHENYL)PROP2ENAMIDE
CCC1=CC=C(C=C1)NC(=O)C(=CC2=CC3=C(C=C2)OCO3)C#N
InChI=1SC19H16N2O3c12133616(7413)2119(22)15(1120)914581718(1014)24122317h310H212H21H3(H2122)b159+
MFCD01804109
N#CC(=Cc1ccc2c(c1)OCO2)C(=O)Nc1ccc(cc1)CC
ZINC000001083699
ZINC01083699
ZINC1083699
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