Vitas-M small molecule compound

(2E)-N-[5-(3-chloro-4-methylbenzyl)-1,3-thiazol-2-yl]-3-[5-chloro-2-(prop-2-en-1-yloxy)phenyl]-2-cyanoprop-2-enamide

Catalog ID
STL016987
SMILES C=CCOc1ccc(cc1/C=C(/C(=O)Nc1ncc(s1)Cc1ccc(c(c1)Cl)C)\C#N)Cl

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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 C24H19Cl2N3O2S MW 484.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19Cl2N3O2S/c1-3-8-31-22-7-6-19(25)12-17(22)11-18(13-27)23(30)29-24-28-14-20(32-24)9-16-5-4-15(2)21(26)10-16/h3-7,10-12,14H,1,8-9H2,2H3,(H,28,29,30)/b18-11+
InChIKey
LDFOUFLWLDNPOR-WOJGMQOQSA-N
Synonyms

(2E)N(5((3CHLORO4METHYLPHENYL)METHYL)(13THIAZOL2YL))3(5CHLORO2PROP2ENYLOXYPHENYL)2CYANOPROP2ENAMIDE
(2E)N(5(3chloro4methylbenzyl)13thiazol2yl)3(5chloro2(prop2en1yloxy)phenyl)2cyanoprop2enamide
(E)N(5((3CHLORO4METHYLPHENYL)METHYL)13THIAZOL2YL)3(5CHLORO2PROP2ENOXYPHENYL)2CYANOPROP2ENAMIDE
C=CCOc1ccc(cc1C=C(C(=O)Nc1ncc(s1)Cc1ccc(c(c1)Cl)C)C#N)Cl
CC1=C(C=C(C=C1)CC2=CN=C(S2)NC(=O)C(=CC3=C(C=CC(=C3)Cl)OCC=C)C#N)Cl
InChI=1SC24H19Cl2N3O2Sc13831227619(25)1217(22)1118(1327)23(30)2924281420(3224)9165415(2)21(26)1016h37101214H189H22H3(H282930)b1811+
MFCD02979611
ZINC000002553703
ZINC02553703
ZINC2553703

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Available files

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