Vitas-M small molecule compound

(2E)-2-[4-(4-butylphenyl)-1,3-thiazol-2-yl]-3-(2,4-diethoxyphenyl)prop-2-enenitrile

Catalog ID
STL015078
SMILES CCCCc1ccc(cc1)c1csc(n1)/C(=C/c1ccc(cc1OCC)OCC)/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 C26H28N2O2S MW 432.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O2S/c1-4-7-8-19-9-11-20(12-10-19)24-18-31-26(28-24)22(17-27)15-21-13-14-23(29-5-2)16-25(21)30-6-3/h9-16,18H,4-8H2,1-3H3/b22-15+
InChIKey
AGEWKCCNEDNUHP-PXLXIMEGSA-N
Synonyms
204640-53-9
(2E)2(4(4butylphenyl)13thiazol2yl)3(24diethoxyphenyl)prop2enenitrile
(2E)3(24DIETHOXYPHENYL)2(4(4BUTYLPHENYL)(13THIAZOL2YL))PROP2ENENITRILE
(E)2(4(4BUTYLPHENYL)13THIAZOL2YL)3(24DIETHOXYPHENYL)PROP2ENENITRILE
(E)2(4(4butylphenyl)thiazol2yl)3(24diethoxyphenyl)acrylonitrile
2(4(4BUTYLPHENYL)THIAZOL2YL)3(24DIETHOXYPHENYL)ACRYLONITRILE
204640539
CCCCC1=CC=C(C=C1)C2=CSC(=N2)C(=CC3=C(C=C(C=C3)OCC)OCC)C#N
CCCCc1ccc(cc1)c1csc(n1)C(=Cc1ccc(cc1OCC)OCC)C#N
InChI=1SC26H28N2O2Sc14781991120(121019)24183126(2824)22(1727)1521131423(2952)1625(21)3063h91618H48H213H3b2215+
MFCD00326605
ZINC000009056828
ZINC09056828
ZINC9056828

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Available files

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