Vitas-M small molecule compound
(2E)-3-(4-tert-butylphenyl)-2-cyano-N-[5-(2,5-dichlorobenzyl)-1,3-thiazol-2-yl]prop-2-enamide
Catalog ID
STK952562
SMILES N#C/C(=C\c1ccc(cc1)C(C)(C)C)/C(=O)Nc1ncc(s1)Cc1cc(Cl)ccc1Cl
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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 C24H21Cl2N3OS MW 470.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21Cl2N3OS/c1-24(2,3)18-6-4-15(5-7-18)10-17(13-27)22(30)29-23-28-14-20(31-23)12-16-11-19(25)8-9-21(16)26/h4-11,14H,12H2,1-3H3,(H,28,29,30)/b17-10+InChIKey
TULVSRGEWHERKR-LICLKQGHSA-NSynonyms
(2E)3(4tertbutylphenyl)2cyanoN(5(25dichlorobenzyl)13thiazol2yl)prop2enamide
(2E)N(5((25DICHLOROPHENYL)METHYL)(13THIAZOL2YL))3(4(TERTBUTYL)PHENYL)2CYANOPROP2ENAMIDE
(E)3(4TERTBUTYLPHENYL)2CYANON(5((25DICHLOROPHENYL)METHYL)13THIAZOL2YL)PROP2ENAMIDE
CC(C)(C)C1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC=C(S2)CC3=C(C=CC(=C3)Cl)Cl
InChI=1SC24H21Cl2N3OSc124(23)186415(5718)1017(1327)22(30)2923281420(3123)12161119(25)8921(16)26h41114H12H213H3(H282930)b1710+
MFCD02654108
N#CC(=Cc1ccc(cc1)C(C)(C)C)C(=O)Nc1ncc(s1)Cc1cc(Cl)ccc1Cl
ZINC000003206189
ZINC03206189
ZINC3206189
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