Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-2-[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile
Catalog ID
STK898590
SMILES N#C/C(=C\c1ccc2c(c1)OCO2)/c1scc(n1)c1ccc(cc1)OC
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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 C20H14N2O3S MW 362.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N2O3S/c1-23-16-5-3-14(4-6-16)17-11-26-20(22-17)15(10-21)8-13-2-7-18-19(9-13)25-12-24-18/h2-9,11H,12H2,1H3/b15-8+InChIKey
LIFQMGXMCCZACS-OVCLIPMQSA-NSynonyms
(2E)3(13benzodioxol5yl)2(4(4methoxyphenyl)13thiazol2yl)prop2enenitrile(E)3(13BENZODIOXOL5YL)2(4(4METHOXYPHENYL)13THIAZOL2YL)PROP2ENENITRILE
COC1=CC=C(C=C1)C2=CSC(=N2)C(=CC3=CC4=C(C=C3)OCO4)C#N
N#CC(=Cc1ccc2c(c1)OCO2)c1scc(n1)c1ccc(cc1)OC
Registry IDs
MFCD18173093ZINC000004175130
ZINC04175130
ZINC4175130
Check stock
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Check stock on Vitas-MAvailable files
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