Vitas-M small molecule compound

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

Catalog ID
STL016993
SMILES N#C/C(=C\c1ccc(cc1)C(C)(C)C)/C(=O)Nc1ncc(s1)Cc1cccc(c1)C(F)(F)F

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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 C25H22F3N3OS MW 469.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22F3N3OS/c1-24(2,3)19-9-7-16(8-10-19)11-18(14-29)22(32)31-23-30-15-21(33-23)13-17-5-4-6-20(12-17)25(26,27)28/h4-12,15H,13H2,1-3H3,(H,30,31,32)/b18-11+
InChIKey
SNPSXKQMCIZWAM-WOJGMQOQSA-N
Synonyms

(2E)3(4(TERTBUTYL)PHENYL)2CYANON(5((3(TRIFLUOROMETHYL)PHENYL)METHYL)(13THIAZOL2YL))PROP2ENAMIDE
(2E)3(4tertbutylphenyl)2cyanoN(5(3(trifluoromethyl)benzyl)13thiazol2yl)prop2enamide
(E)3(4TERTBUTYLPHENYL)2CYANON(5((3(TRIFLUOROMETHYL)PHENYL)METHYL)13THIAZOL2YL)PROP2ENAMIDE
CC(C)(C)C1=CC=C(C=C1)C=C(C#N)C(=O)NC2=NC=C(S2)CC3=CC(=CC=C3)C(F)(F)F
InChI=1SC25H22F3N3OSc124(23)199716(81019)1118(1429)22(32)3123301521(3323)131754620(1217)25(2627)28h41215H13H213H3(H303132)b1811+
MFCD02979524
N#CC(=Cc1ccc(cc1)C(C)(C)C)C(=O)Nc1ncc(s1)Cc1cccc(c1)C(F)(F)F
ZINC000002553597
ZINC02553597
ZINC2553597

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Available files

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