Vitas-M small molecule compound
(2E)-3-(4-butoxy-3-methoxyphenyl)-2-cyano-N-[5-(4-methylbenzyl)-1,3-thiazol-2-yl]prop-2-enamide
Catalog ID
STL019249
SMILES CCCCOc1ccc(cc1OC)/C=C(/C(=O)Nc1ncc(s1)Cc1ccc(cc1)C)\C#N
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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 C26H27N3O3S MW 461.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O3S/c1-4-5-12-32-23-11-10-20(15-24(23)31-3)13-21(16-27)25(30)29-26-28-17-22(33-26)14-19-8-6-18(2)7-9-19/h6-11,13,15,17H,4-5,12,14H2,1-3H3,(H,28,29,30)/b21-13+InChIKey
JKDUHTSREYYIGN-FYJGNVAPSA-NSynonyms
(2E)3(4BUTOXY3METHOXYPHENYL)2CYANON(5((4METHYLPHENYL)METHYL)(13THIAZOL2YL))PROP2ENAMIDE
(2E)3(4butoxy3methoxyphenyl)2cyanoN(5(4methylbenzyl)13thiazol2yl)prop2enamide
(E)3(4BUTOXY3METHOXYPHENYL)2CYANON(5((4METHYLPHENYL)METHYL)13THIAZOL2YL)PROP2ENAMIDE
CCCCOC1=C(C=C(C=C1)C=C(C#N)C(=O)NC2=NC=C(S2)CC3=CC=C(C=C3)C)OC
CCCCOc1ccc(cc1OC)C=C(C(=O)Nc1ncc(s1)Cc1ccc(cc1)C)C#N
InChI=1SC26H27N3O3Sc145123223111020(1524(23)313)1321(1627)25(30)2926281722(3326)14198618(2)7919h611131517H451214H213H3(H282930)b2113+
MFCD02979481
ZINC000008763835
ZINC08763835
ZINC8763835
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