Vitas-M small molecule compound

1-(2,5-dimethylphenyl)-2-(9H-purin-6-ylsulfanyl)ethanone

Catalog ID
STK278572
SMILES Cc1ccc(c(c1)C(=O)CSc1ncnc2c1nc[nH]2)C

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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 C15H14N4OS MW 298.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14N4OS/c1-9-3-4-10(2)11(5-9)12(20)6-21-15-13-14(17-7-16-13)18-8-19-15/h3-5,7-8H,6H2,1-2H3,(H,16,17,18,19)
InChIKey
YHABQIWKSGUVDF-UHFFFAOYSA-N
Synonyms
917217-11-9
1(25DIMETHYLPHENYL)2(7HPURIN6YLSULFANYL)ETHANONE
1(25dimethylphenyl)2(9Hpurin6ylsulfanyl)ethanone
CC1=CC(=C(C=C1)C)C(=O)CSC2=NC=NC3=C2NC=N3
Cc1ccc(c(c1)C(=O)CSc1ncnc2c1nc(nH)2)C
Registry IDs
MFCD09269367
ZINC000007344160
ZINC07344160
ZINC7344160

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Available files

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