Vitas-M small molecule compound
(2E)-3-(4-tert-butylphenyl)-2-cyano-N-[5-(4-methylbenzyl)-1,3-thiazol-2-yl]prop-2-enamide
Catalog ID
STL017045
SMILES N#C/C(=C\c1ccc(cc1)C(C)(C)C)/C(=O)Nc1ncc(s1)Cc1ccc(cc1)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 C25H25N3OS MW 415.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3OS/c1-17-5-7-19(8-6-17)14-22-16-27-24(30-22)28-23(29)20(15-26)13-18-9-11-21(12-10-18)25(2,3)4/h5-13,16H,14H2,1-4H3,(H,27,28,29)/b20-13+InChIKey
MWUXPXNHSYLTRM-DEDYPNTBSA-NSynonyms
(2E)3(4(TERTBUTYL)PHENYL)2CYANON(5((4METHYLPHENYL)METHYL)(13THIAZOL2YL))PROP2ENAMIDE
(2E)3(4tertbutylphenyl)2cyanoN(5(4methylbenzyl)13thiazol2yl)prop2enamide
(E)3(4tertbutylphenyl)2cyanoN(5((4methylphenyl)methyl)13thiazol2yl)prop2enamide
CC1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)C(=CC3=CC=C(C=C3)C(C)(C)C)C#N
InChI=1SC25H25N3OSc1175719(8617)1422162724(3022)2823(29)20(1526)131891121(121018)25(23)4h51316H14H214H3(H272829)b2013+
MFCD02979462
N#CC(=Cc1ccc(cc1)C(C)(C)C)C(=O)Nc1ncc(s1)Cc1ccc(cc1)C
ZINC000000954293
ZINC00954293
ZINC954293
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