Vitas-M small molecule compound

2-[(3,5-difluorobenzyl)sulfanyl]-3-(3-ethoxypropyl)quinazolin-4(3H)-one

Catalog ID
STL106585
SMILES CCOCCCn1c(SCc2cc(F)cc(c2)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 C20H20F2N2O2S MW 390.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20F2N2O2S/c1-2-26-9-5-8-24-19(25)17-6-3-4-7-18(17)23-20(24)27-13-14-10-15(21)12-16(22)11-14/h3-4,6-7,10-12H,2,5,8-9,13H2,1H3
InChIKey
VOCATQPTYVGGLN-UHFFFAOYSA-N
Synonyms
2((35difluorobenzyl)sulfanyl)3(3ethoxypropyl)quinazolin4(3H)one
2((35difluorophenyl)methylsulfanyl)3(3ethoxypropyl)quinazolin4one
CCOCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC(=CC(=C3)F)F
Registry IDs
MFCD20737891
ZINC000067259173
ZINC67259173

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Available files

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