Vitas-M small molecule compound

1-(3,4-dihydroquinolin-1(2H)-yl)-2-{[2-(3-fluorophenyl)-6-methylpyrimidin-4-yl]sulfanyl}ethanone

Catalog ID
STL105947
SMILES Cc1cc(SCC(=O)N2CCCc3c2cccc3)nc(n1)c1cccc(c1)F

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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 C22H20FN3OS MW 393.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20FN3OS/c1-15-12-20(25-22(24-15)17-7-4-9-18(23)13-17)28-14-21(27)26-11-5-8-16-6-2-3-10-19(16)26/h2-4,6-7,9-10,12-13H,5,8,11,14H2,1H3
InChIKey
ZUPHCYBVFOKSER-UHFFFAOYSA-N
Synonyms

1(34dihydro2Hquinolin1yl)2(2(3fluorophenyl)6methylpyrimidin4yl)sulfanylethanone
1(34dihydroquinolin1(2H)yl)2((2(3fluorophenyl)6methylpyrimidin4yl)sulfanyl)ethanone
CC1=CC(=NC(=N1)C2=CC(=CC=C2)F)SCC(=O)N3CCCC4=CC=CC=C43
InChI=1SC22H20FN3OSc1151220(2522(2415)1774918(23)1317)281421(27)261158166231019(16)26h24679101213H581114H21H3
MFCD20737138
ZINC000067257261
ZINC67257261

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Available files

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