Vitas-M small molecule compound
(2E)-2-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-(2-ethoxyphenyl)prop-2-enenitrile
Catalog ID
STK803862
SMILES CCOc1ccccc1/C=C(/c1scc(n1)c1ccc2c(c1)OCO2)\C#N
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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 C21H16N2O3S MW 376.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16N2O3S/c1-2-24-18-6-4-3-5-15(18)9-16(11-22)21-23-17(12-27-21)14-7-8-19-20(10-14)26-13-25-19/h3-10,12H,2,13H2,1H3/b16-9+InChIKey
TYWZWMILKBPCEG-CXUHLZMHSA-NSynonyms
(2E)2(4(13benzodioxol5yl)13thiazol2yl)3(2ethoxyphenyl)prop2enenitrile
(E)2(4(13BENZODIOXOL5YL)13THIAZOL2YL)3(2ETHOXYPHENYL)PROP2ENENITRILE
CCOC1=CC=CC=C1C=C(C#N)C2=NC(=CS2)C3=CC4=C(C=C3)OCO4
CCOc1ccccc1C=C(c1scc(n1)c1ccc2c(c1)OCO2)C#N
InChI=1SC21H16N2O3Sc122418643515(18)916(1122)212317(122721)14781920(1014)26132519h31012H213H21H3b169+
MFCD01455154
ZINC000005008893
ZINC05008893
ZINC5008893
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