Vitas-M small molecule compound
3-pentyl-2-{[2-(trifluoromethyl)benzyl]sulfanyl}quinazolin-4(3H)-one
Catalog ID
STL106503
SMILES CCCCCn1c(SCc2ccccc2C(F)(F)F)nc2c(c1=O)cccc2
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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 C21H21F3N2OS MW 406.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21F3N2OS/c1-2-3-8-13-26-19(27)16-10-5-7-12-18(16)25-20(26)28-14-15-9-4-6-11-17(15)21(22,23)24/h4-7,9-12H,2-3,8,13-14H2,1H3InChIKey
IHFUELPSSXMFIZ-UHFFFAOYSA-NSynonyms
3pentyl2((2(trifluoromethyl)benzyl)sulfanyl)quinazolin4(3H)one
3pentyl2((2(trifluoromethyl)phenyl)methylsulfanyl)quinazolin4one
CCCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=CC=C3C(F)(F)F
InChI=1SC21H21F3N2OSc1238132619(27)1610571218(16)2520(26)2814159461117(15)21(2223)24h47912H2381314H21H3
MFCD20737815
ZINC000067259041
ZINC67259041
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