Vitas-M small molecule compound

6-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-9H-purine

Catalog ID
STK760765
SMILES C1Oc2c(O1)cc(cc2)CSc1ncnc2c1nc[nH]2

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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 C13H10N4O2S MW 286.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H10N4O2S/c1-2-9-10(19-7-18-9)3-8(1)4-20-13-11-12(15-5-14-11)16-6-17-13/h1-3,5-6H,4,7H2,(H,14,15,16,17)
InChIKey
KRBFLOBPUMORJO-UHFFFAOYSA-N
Synonyms
296882-76-3
296882763
6((13benzodioxol5ylmethyl)sulfanyl)9Hpurine
6(13BENZODIOXOL5YLMETHYLSULFANYL)7HPURINE
6(2HBENZO(34D)13DIOXOLAN5YLMETHYLTHIO)PURINE
6(BENZO(13)DIOXOL5YLMETHYLSULFANYL)9HPURINE
9HPURINE6((13BENZODIOXOL5YLMETHYL)THIO)
C1OC2=C(O1)C=C(C=C2)CSC3=NC=NC4=C3NC=N4
C1Oc2c(O1)cc(cc2)CSc1ncnc2c1nc(nH)2
InChI=1SC13H10N4O2Sc12910(197189)38(1)420131112(1551411)1661713h1356H47H2(H14151617)
MFCD01819631
ZINC000008553458
ZINC08553458
ZINC8553458

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Available files

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