Vitas-M small molecule compound

2-([1]benzofuro[3,2-d]pyrimidin-4-ylsulfanyl)cyclohexanone

Catalog ID
STK586653
SMILES O=C1CCCCC1Sc1ncnc2c1oc1c2cccc1

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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 C16H14N2O2S MW 298.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N2O2S/c19-11-6-2-4-8-13(11)21-16-15-14(17-9-18-16)10-5-1-3-7-12(10)20-15/h1,3,5,7,9,13H,2,4,6,8H2
InChIKey
DFCPJJXSAMEXJM-UHFFFAOYSA-N
Synonyms
848766-61-0
2((1)BENZOFURO(32D)PYRIMIDIN4YLSULFANYL)CYCLOHEXAN1ONE
2((1)benzofuro(32d)pyrimidin4ylsulfanyl)cyclohexanone
2(benzofuro(32d)pyrimidin4ylthio)cyclohexanone
848766610
C1CCC(=O)C(C1)SC2=NC=NC3=C2OC4=CC=CC=C43
InChI=1SC16H14N2O2Sc1911624813(11)21161514(1791816)10513712(10)2015h1357913H2468H2
MFCD04193139
ZINC000000544891
ZINC000005271739

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Available files

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