Vitas-M small molecule compound
(2E)-N-[5-(3-chloro-4-methylbenzyl)-1,3-thiazol-2-yl]-2-cyano-3-(2-methylphenyl)prop-2-enamide
Catalog ID
STL016986
SMILES N#C/C(=C\c1ccccc1C)/C(=O)Nc1ncc(s1)Cc1ccc(c(c1)Cl)C
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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 C22H18ClN3OS MW 407.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN3OS/c1-14-5-3-4-6-17(14)11-18(12-24)21(27)26-22-25-13-19(28-22)9-16-8-7-15(2)20(23)10-16/h3-8,10-11,13H,9H2,1-2H3,(H,25,26,27)/b18-11+InChIKey
XYCBGJBHRKBFTI-WOJGMQOQSA-NSynonyms
(2E)N(5((3CHLORO4METHYLPHENYL)METHYL)(13THIAZOL2YL))2CYANO3(2METHYLPHENYL)PROP2ENAMIDE
(2E)N(5(3chloro4methylbenzyl)13thiazol2yl)2cyano3(2methylphenyl)prop2enamide
(E)N(5((3chloro4methylphenyl)methyl)13thiazol2yl)2cyano3(2methylphenyl)prop2enamide
CC1=C(C=C(C=C1)CC2=CN=C(S2)NC(=O)C(=CC3=CC=CC=C3C)C#N)Cl
InChI=1SC22H18ClN3OSc114534617(14)1118(1224)21(27)2622251319(2822)9168715(2)20(23)1016h38101113H9H212H3(H252627)b1811+
MFCD02979588
N#CC(=Cc1ccccc1C)C(=O)Nc1ncc(s1)Cc1ccc(c(c1)Cl)C
ZINC000000954309
ZINC00954309
ZINC954309
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