Vitas-M small molecule compound
(2Z)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-(4-ethylphenyl)prop-2-enenitrile
Catalog ID
STK834419
SMILES N#C/C(=C/c1ccc(cc1)CC)/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 C21H16N2O2S MW 360.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N2O2S/c1-2-14-3-5-15(6-4-14)9-17(11-22)21-23-18(12-26-21)16-7-8-19-20(10-16)25-13-24-19/h3-10,12H,2,13H2,1H3/b17-9-InChIKey
BRURHRXYVZPZOZ-MFOYZWKCSA-NSynonyms
374549-05-0(2Z)2(4(13benzodioxol5yl)13thiazol2yl)3(4ethylphenyl)prop2enenitrile
(Z)2(4(13BENZODIOXOL5YL)13THIAZOL2YL)3(4ETHYLPHENYL)PROP2ENENITRILE
(Z)2(4(benzo(d)(13)dioxol5yl)thiazol2yl)3(4ethylphenyl)acrylonitrile
374549050
CCC1=CC=C(C=C1)C=C(C#N)C2=NC(=CS2)C3=CC4=C(C=C3)OCO4
InChI=1SC21H16N2O2Sc12143515(6414)917(1122)212318(122621)16781920(1016)25132419h31012H213H21H3b179
MFCD01957164
N#CC(=Cc1ccc(cc1)CC)c1scc(n1)c1ccc2c(c1)OCO2
ZINC000013775205
ZINC13775205
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