Vitas-M small molecule compound
(2E)-2-cyano-N-[5-(2,4-dichlorobenzyl)-1,3-thiazol-2-yl]-3-[4-(propan-2-yl)phenyl]prop-2-enamide
Catalog ID
STL017116
SMILES N#C/C(=C\c1ccc(cc1)C(C)C)/C(=O)Nc1ncc(s1)Cc1ccc(cc1Cl)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 C23H19Cl2N3OS MW 456.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19Cl2N3OS/c1-14(2)16-5-3-15(4-6-16)9-18(12-26)22(29)28-23-27-13-20(30-23)10-17-7-8-19(24)11-21(17)25/h3-9,11,13-14H,10H2,1-2H3,(H,27,28,29)/b18-9+InChIKey
NVESBZDUGVDUBY-GIJQJNRQSA-NSynonyms
(2E)2cyanoN(5(24dichlorobenzyl)13thiazol2yl)3(4(propan2yl)phenyl)prop2enamide
(2E)N(5((24DICHLOROPHENYL)METHYL)(13THIAZOL2YL))2CYANO3(4(METHYLETHYL)PHENYL)PROP2ENAMIDE
(E)2CYANON(5((24DICHLOROPHENYL)METHYL)13THIAZOL2YL)3(4PROPAN2YLPHENYL)PROP2ENAMIDE
CC(C)C1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC=C(S2)CC3=C(C=C(C=C3)Cl)Cl
InChI=1SC23H19Cl2N3OSc114(2)165315(4616)918(1226)22(29)2823271320(3023)10177819(24)1121(17)25h39111314H10H212H3(H272829)b189+
MFCD02979344
N#CC(=Cc1ccc(cc1)C(C)C)C(=O)Nc1ncc(s1)Cc1ccc(cc1Cl)Cl
ZINC000002553438
ZINC02553438
ZINC2553438
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