Vitas-M small molecule compound

6-(4-ethoxyphenyl)-2-(prop-2-en-1-ylsulfanyl)-4-(trifluoromethyl)pyridine-3-carbonitrile

Catalog ID
STK812647
SMILES C=CCSc1nc(cc(c1C#N)C(F)(F)F)c1ccc(cc1)OCC

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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 C18H15F3N2OS MW 364.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15F3N2OS/c1-3-9-25-17-14(11-22)15(18(19,20)21)10-16(23-17)12-5-7-13(8-6-12)24-4-2/h3,5-8,10H,1,4,9H2,2H3
InChIKey
ZJMJDIAUROOAJC-UHFFFAOYSA-N
Synonyms

6(4ethoxyphenyl)2(prop2en1ylsulfanyl)4(trifluoromethyl)pyridine3carbonitrile
6(4ETHOXYPHENYL)2PROP2ENYLSULFANYL4(TRIFLUOROMETHYL)PYRIDINE3CARBONITRILE
CCOC1=CC=C(C=C1)C2=NC(=C(C(=C2)C(F)(F)F)C#N)SCC=C
InChI=1SC18H15F3N2OSc139251714(1122)15(18(1920)21)1016(2317)125713(8612)2442h35810H149H22H3
MFCD04445871
ZINC000003637037
ZINC03637037
ZINC3637037

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Available files

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