Vitas-M small molecule compound

1-(2,4-dichlorophenyl)-2-(7H-purin-6-ylsulfanyl)ethanone

Catalog ID
STK519512
SMILES Clc1ccc(c(c1)Cl)C(=O)CSc1ncnc2c1[nH]cn2

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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 C13H8Cl2N4OS MW 339.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H8Cl2N4OS/c14-7-1-2-8(9(15)3-7)10(20)4-21-13-11-12(17-5-16-11)18-6-19-13/h1-3,5-6H,4H2,(H,16,17,18,19)
InChIKey
SURXSUZCYSHHSG-UHFFFAOYSA-N
Synonyms
710288-92-9
1(24dichlorophenyl)2(7Hpurin6ylsulfanyl)ethanone
1(24DICHLOROPHENYL)2PURIN6YLTHIOETHAN1ONE
710288929
C1=CC(=C(C=C1Cl)Cl)C(=O)CSC2=NC=NC3=C2NC=N3
Clc1ccc(c(c1)Cl)C(=O)CSc1ncnc2c1(nH)cn2
InChI=1SC13H8Cl2N4OSc147128(9(15)37)10(20)421131112(1751611)1861913h1356H4H2(H16171819)
MFCD06250186
ZINC000006565564
ZINC06565564
ZINC6565564

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Available files

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