Vitas-M small molecule compound

2-{[6-(4-butoxyphenyl)-3-cyano-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-(4-methoxyphenyl)acetamide

Catalog ID
STK812493
SMILES CCCCOc1ccc(cc1)c1nc(SCC(=O)Nc2ccc(cc2)OC)c(c(c1)C(F)(F)F)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 C26H24F3N3O3S MW 515.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24F3N3O3S/c1-3-4-13-35-20-9-5-17(6-10-20)23-14-22(26(27,28)29)21(15-30)25(32-23)36-16-24(33)31-18-7-11-19(34-2)12-8-18/h5-12,14H,3-4,13,16H2,1-2H3,(H,31,33)
InChIKey
KSJKBPXBGCXHNS-UHFFFAOYSA-N
Synonyms
2((6(4butoxyphenyl)3cyano4(trifluoromethyl)pyridin2yl)sulfanyl)N(4methoxyphenyl)acetamide
2(6(4BUTOXYPHENYL)3CYANO4(TRIFLUOROMETHYL)PYRIDIN2YL)SULFANYLN(4METHOXYPHENYL)ACETAMIDE
CCCCOC1=CC=C(C=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCC(=O)NC3=CC=C(C=C3)OC
Registry IDs
MFCD06265013
ZINC000016728933
ZINC16728933

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Available files

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