Vitas-M small molecule compound
6-{[3-(trifluoromethyl)benzyl]sulfanyl}-7H-purine
Catalog ID
STL226854
SMILES FC(c1cccc(c1)CSc1ncnc2c1[nH]cn2)(F)F
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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 C13H9F3N4S MW 310.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9F3N4S/c14-13(15,16)9-3-1-2-8(4-9)5-21-12-10-11(18-6-17-10)19-7-20-12/h1-4,6-7H,5H2,(H,17,18,19,20)InChIKey
GTVGINQLSNFIIQ-UHFFFAOYSA-NSynonyms
1112281-40-91112281409
6((3(trifluoromethyl)benzyl)sulfanyl)7Hpurine
6((3(trifluoromethyl)phenyl)methylsulfanyl)7Hpurine
C1=CC(=CC(=C1)C(F)(F)F)CSC2=NC=NC3=C2NC=N3
FC(c1cccc(c1)CSc1ncnc2c1(nH)cn2)(F)F
InChI=1SC13H9F3N4Sc1413(1516)93128(49)521121011(1861710)1972012h1467H5H2(H17181920)
MFCD24858228
ZINC000033328701
ZINC33328701
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