Vitas-M small molecule compound

2-{[3-cyano-4-(2-ethoxyphenyl)-5-hydroxy-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}-N-(2,4,6-trimethylphenyl)acetamide

Catalog ID
STK562997
SMILES CCOc1ccccc1C1C(=C(SCC(=O)Nc2c(C)cc(cc2C)C)N=C2C1=C(O)CCC2)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 C29H31N3O3S MW 501.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N3O3S/c1-5-35-24-12-7-6-9-20(24)26-21(15-30)29(31-22-10-8-11-23(33)27(22)26)36-16-25(34)32-28-18(3)13-17(2)14-19(28)4/h6-7,9,12-14,26,33H,5,8,10-11,16H2,1-4H3,(H,32,34)
InChIKey
UHFRIZPWLOIEIF-UHFFFAOYSA-N
Synonyms

2((3cyano4(2ethoxyphenyl)5hydroxy4678tetrahydroquinolin2yl)sulfanyl)N(246trimethylphenyl)acetamide
MFCD03817180
ZINC000102516938
ZINC000102516943

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Available files

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