Vitas-M small molecule compound

(2E)-2-cyano-N-[5-(2,3-dichlorobenzyl)-1,3-thiazol-2-yl]-3-(4-ethoxyphenyl)prop-2-enamide

Catalog ID
STL017089
SMILES CCOc1ccc(cc1)/C=C(/C(=O)Nc1ncc(s1)Cc1cccc(c1Cl)Cl)\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 C22H17Cl2N3O2S MW 458.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17Cl2N3O2S/c1-2-29-17-8-6-14(7-9-17)10-16(12-25)21(28)27-22-26-13-18(30-22)11-15-4-3-5-19(23)20(15)24/h3-10,13H,2,11H2,1H3,(H,26,27,28)/b16-10+
InChIKey
JCRKXOZOUWRCNU-MHWRWJLKSA-N
Synonyms

(2E)2cyanoN(5(23dichlorobenzyl)13thiazol2yl)3(4ethoxyphenyl)prop2enamide
(2E)N(5((23DICHLOROPHENYL)METHYL)(13THIAZOL2YL))2CYANO3(4ETHOXYPHENYL)PROP2ENAMIDE
(E)2CYANON(5((23DICHLOROPHENYL)METHYL)13THIAZOL2YL)3(4ETHOXYPHENYL)PROP2ENAMIDE
CCOC1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC=C(S2)CC3=C(C(=CC=C3)Cl)Cl
CCOc1ccc(cc1)C=C(C(=O)Nc1ncc(s1)Cc1cccc(c1Cl)Cl)C#N
InChI=1SC22H17Cl2N3O2Sc1229178614(7917)1016(1225)21(28)2722261318(3022)111543519(23)20(15)24h31013H211H21H3(H262728)b1610+
MFCD02979327
ZINC000001906182
ZINC01906182
ZINC1906182

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Available files

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