Vitas-M small molecule compound

7-(2-chlorobenzyl)-1,3-dimethyl-8-(pyrimidin-2-ylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK848981
SMILES Clc1ccccc1Cn1c(Sc2ncccn2)nc2c1c(=O)n(c(=O)n2C)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 C18H15ClN6O2S MW 414.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15ClN6O2S/c1-23-14-13(15(26)24(2)18(23)27)25(10-11-6-3-4-7-12(11)19)17(22-14)28-16-20-8-5-9-21-16/h3-9H,10H2,1-2H3
InChIKey
JVHHMZHBZJFENR-UHFFFAOYSA-N
Synonyms
868213-91-6
7((2CHLOROPHENYL)METHYL)13DIMETHYL8PYRIMIDIN2YLSULFANYLPURINE26DIONE
7((2CHLOROPHENYL)METHYL)13DIMETHYL8PYRIMIDIN2YLTHIO137TRIHYDROPURINE26DIONE
7(2chlorobenzyl)13dimethyl8(pyrimidin2ylsulfanyl)37dihydro1Hpurine26dione
7(2CHLOROBENZYL)13DIMETHYL8(PYRIMIDIN2YLSULFANYL)37DIHYDROPURINE26DIONE
7(2CHLOROBENZYL)13DIMETHYL8(PYRIMIDIN2YLTHIO)1HPURINE26(3H7H)DIONE
868213916
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SC3=NC=CC=N3)CC4=CC=CC=C4Cl
InChI=1SC18H15ClN6O2Sc1231413(15(26)24(2)18(23)27)25(1011634712(11)19)17(2214)2816208592116h39H10H212H3
MFCD06405573
ZINC000002363831
ZINC02363831
ZINC2363831

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Available files

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