Vitas-M small molecule compound
1-{[1-(4-chlorophenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl}-3,3-dimethylbutan-2-one
Catalog ID
STL349357
SMILES Clc1ccc(cc1)n1ncc2c1ncnc2SCC(=O)C(C)(C)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 C17H17ClN4OS MW 360.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClN4OS/c1-17(2,3)14(23)9-24-16-13-8-21-22(15(13)19-10-20-16)12-6-4-11(18)5-7-12/h4-8,10H,9H2,1-3H3InChIKey
XRYIDVBEHMRBGT-UHFFFAOYSA-NSynonyms
877804-32-51((1(4chlorophenyl)1Hpyrazolo(34d)pyrimidin4yl)sulfanyl)33dimethylbutan2one
1((1(4chlorophenyl)1Hpyrazolo(34d)pyrimidin4yl)thio)33dimethylbutan2one
1(1(4CHLOROPHENYL)PYRAZOLO(34D)PYRIMIDIN4YL)SULFANYL33DIMETHYLBUTAN2ONE
877804325
CC(C)(C)C(=O)CSC1=NC=NC2=C1C=NN2C3=CC=C(C=C3)Cl
InChI=1SC17H17ClN4OSc117(23)14(23)924161382122(15(13)19102016)126411(18)5712h4810H9H213H3
MFCD05704666
ZINC000005576155
ZINC05576155
ZINC5576155
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