Vitas-M small molecule compound

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

Catalog ID
STL017115
SMILES N#C/C(=C\c1ccc(cc1)C(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 C24H21Cl2N3OS MW 470.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21Cl2N3OS/c1-24(2,3)18-7-4-15(5-8-18)10-17(13-27)22(30)29-23-28-14-20(31-23)11-16-6-9-19(25)12-21(16)26/h4-10,12,14H,11H2,1-3H3,(H,28,29,30)/b17-10+
InChIKey
RFWFQNQKHAUZPP-LICLKQGHSA-N
Synonyms

(2E)3(4tertbutylphenyl)2cyanoN(5(24dichlorobenzyl)13thiazol2yl)prop2enamide
(2E)N(5((24DICHLOROPHENYL)METHYL)(13THIAZOL2YL))3(4(TERTBUTYL)PHENYL)2CYANOPROP2ENAMIDE
(E)3(4TERTBUTYLPHENYL)2CYANON(5((24DICHLOROPHENYL)METHYL)13THIAZOL2YL)PROP2ENAMIDE
CC(C)(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=1SC24H21Cl2N3OSc124(23)187415(5818)1017(1327)22(30)2923281420(3123)11166919(25)1221(16)26h4101214H11H213H3(H282930)b1710+
MFCD02979345
N#CC(=Cc1ccc(cc1)C(C)(C)C)C(=O)Nc1ncc(s1)Cc1ccc(cc1Cl)Cl
ZINC000002553443
ZINC02553443
ZINC2553443

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Available files

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