Vitas-M small molecule compound
(2Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-(4-methylphenyl)prop-2-enenitrile
Catalog ID
STK833935
SMILES N#C/C(=C/c1ccc(cc1)C)/c1scc(n1)c1ccc2c(c1)OCO2
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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 C20H14N2O2S MW 346.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14N2O2S/c1-13-2-4-14(5-3-13)8-16(10-21)20-22-17(11-25-20)15-6-7-18-19(9-15)24-12-23-18/h2-9,11H,12H2,1H3/b16-8-InChIKey
WNBLLFWAODMZLM-PXNMLYILSA-NSynonyms
(2Z)2(4(13benzodioxol5yl)13thiazol2yl)3(4methylphenyl)prop2enenitrile
(Z)2(4(13BENZODIOXOL5YL)13THIAZOL2YL)3(4METHYLPHENYL)PROP2ENENITRILE
(Z)2(4(benzo(d)(13)dioxol5yl)thiazol2yl)3(ptolyl)acrylonitrile
CC1=CC=C(C=C1)C=C(C#N)C2=NC(=CS2)C3=CC4=C(C=C3)OCO4
InChI=1SC20H14N2O2Sc1132414(5313)816(1021)202217(112520)15671819(915)24122318h2911H12H21H3b168
MFCD01959754
N#CC(=Cc1ccc(cc1)C)c1scc(n1)c1ccc2c(c1)OCO2
ZINC000004833591
ZINC04833591
ZINC4833591
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