Vitas-M small molecule compound

(2E)-3-(4-butoxy-3-methoxyphenyl)-N-[5-(2-chlorobenzyl)-1,3-thiazol-2-yl]-2-cyanoprop-2-enamide

Catalog ID
STL019251
SMILES CCCCOc1ccc(cc1OC)/C=C(/C(=O)Nc1ncc(s1)Cc1ccccc1Cl)\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 C25H24ClN3O3S MW 482.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24ClN3O3S/c1-3-4-11-32-22-10-9-17(13-23(22)31-2)12-19(15-27)24(30)29-25-28-16-20(33-25)14-18-7-5-6-8-21(18)26/h5-10,12-13,16H,3-4,11,14H2,1-2H3,(H,28,29,30)/b19-12+
InChIKey
TVVGEDGVXNRNAV-XDHOZWIPSA-N
Synonyms

(2E)3(4BUTOXY3METHOXYPHENYL)N(5((2CHLOROPHENYL)METHYL)(13THIAZOL2YL))2CYANOPROP2ENAMIDE
(2E)3(4butoxy3methoxyphenyl)N(5(2chlorobenzyl)13thiazol2yl)2cyanoprop2enamide
(E)3(4BUTOXY3METHOXYPHENYL)N(5((2CHLOROPHENYL)METHYL)13THIAZOL2YL)2CYANOPROP2ENAMIDE
CCCCOC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=NC=C(S2)CC3=CC=CC=C3Cl)OC
CCCCOc1ccc(cc1OC)C=C(C(=O)Nc1ncc(s1)Cc1ccccc1Cl)C#N
InChI=1SC25H24ClN3O3Sc13411322210917(1323(22)312)1219(1527)24(30)2925281620(3325)1418756821(18)26h510121316H341114H212H3(H282930)b1912+
MFCD02979208
ZINC000001905875
ZINC01905875
ZINC1905875

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Available files

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