Vitas-M small molecule compound
3-(3-ethoxypropyl)-2-{[2-(trifluoromethyl)benzyl]sulfanyl}quinazolin-4(3H)-one
Catalog ID
STL106596
SMILES CCOCCCn1c(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 C21H21F3N2O2S MW 422.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21F3N2O2S/c1-2-28-13-7-12-26-19(27)16-9-4-6-11-18(16)25-20(26)29-14-15-8-3-5-10-17(15)21(22,23)24/h3-6,8-11H,2,7,12-14H2,1H3InChIKey
ABTOKWZNDNFOAX-UHFFFAOYSA-NSynonyms
3(3ethoxypropyl)2((2(trifluoromethyl)benzyl)sulfanyl)quinazolin4(3H)one
3(3ethoxypropyl)2((2(trifluoromethyl)phenyl)methylsulfanyl)quinazolin4one
CCOCCCN1C(=O)C2=CC=CC=C2N=C1SCC3=CC=CC=C3C(F)(F)F
InChI=1SC21H21F3N2O2Sc1228137122619(27)169461118(16)2520(26)2914158351017(15)21(2223)24h36811H271214H21H3
MFCD20737898
ZINC000067259189
ZINC67259189
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