Vitas-M small molecule compound
2-[(9-methyl-6-oxo-6,9-dihydro-1H-purin-8-yl)sulfanyl]-N-(2,3,5,6-tetrafluorophenyl)acetamide
Catalog ID
STK497016
SMILES O=C(Nc1c(F)c(F)cc(c1F)F)CSc1nc2c(n1C)nc[nH]c2=O
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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 C14H9F4N5O2S MW 387.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H9F4N5O2S/c1-23-12-11(13(25)20-4-19-12)22-14(23)26-3-7(24)21-10-8(17)5(15)2-6(16)9(10)18/h2,4H,3H2,1H3,(H,21,24)(H,19,20,25)InChIKey
OBPWTQKGJARLQN-UHFFFAOYSA-NSynonyms
2((9methyl6oxo3Hpurin8yl)sulfanyl)N(2356tetrafluorophenyl)acetamide
2((9methyl6oxo69dihydro1Hpurin8yl)sulfanyl)N(2356tetrafluorophenyl)acetamide
CN1C2=C(C(=O)N=CN2)N=C1SCC(=O)NC3=C(C(=CC(=C3F)F)F)F
InChI=1SC14H9F4N5O2Sc1231211(13(25)2041912)2214(23)2637(24)21108(17)5(15)26(16)9(10)18h24H3H21H3(H2124)(H192025)
MFCD09788416
O=C(Nc1c(F)c(F)cc(c1F)F)CSc1nc2c(n1C)nc(nH)c2=O
ZINC000012427842
ZINC12427842
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