Vitas-M small molecule compound

2-[3-cyano-4-(2-methylpropoxy)phenyl]-4-methyl-1,3-thiazole-5-carboxylic acid

Catalog ID
STL559020
SMILES N#Cc1cc(ccc1OCC(C)C)c1nc(c(s1)C(=O)O)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 C16H16N2O3S MW 316.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N2O3S/c1-9(2)8-21-13-5-4-11(6-12(13)7-17)15-18-10(3)14(22-15)16(19)20/h4-6,9H,8H2,1-3H3,(H,19,20)
InChIKey
BQSJTQLCZDPROO-UHFFFAOYSA-N
Synonyms
144060-53-7
134018
144060537
2(3cyano4(2methylpropoxy)phenyl)4methyl13thiazole5carboxylicacid
2(3CYANO4(2METHYLPROPOXY)PHENYL)4METHYL5THIAZOLECARBOXYLICACID
2(3CYANO4(2METHYLPROPOXY)PHENYL)4METHYLTHIAZOLE5CARBOXYLICACID
2(3CYANO4ISOBUTOXYPHENYL)4ME
2(3CYANO4ISOBUTOXYPHENYL)4METHYL13THIAZOLE5CARBOXYLICACID
2(3CYANO4ISOBUTOXYPHENYL)4METHYL5THIAZOLECARBOXYLICACID
2(3CYANO4ISOBUTOXYPHENYL)4METHYLTHIAZOLE5CARBOXYLICACID
2(3CYANO4ISOBUTYLOXY)PHENYL4METHYL5THIAZOLECARBOXYLICACID
5THIAZOLECARBOXYLICACID2(3CYANO4(2METHYLPROPOXY)PHENYL)4METHYL
FEBUXOSTAT(JANUSANINN)
FEBUXOSTAT(USANINNBAN)
InChI=1SC16H16N2O3Sc19(2)821135411(612(13)717)151810(3)14(2215)16(19)20h469H8H213H3(H1920)
MFCD00871598
THYLTHIAZOLE5CARBOXYLICACID
ZINC000000005423

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.