Vitas-M small molecule compound

8-[(2-chlorobenzyl)sulfanyl]-1,3-dimethyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK544645
SMILES CC(CCn1c(SCc2ccccc2Cl)nc2c1c(=O)n(c(=O)n2C)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 C19H23ClN4O2S MW 406.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23ClN4O2S/c1-12(2)9-10-24-15-16(22(3)19(26)23(4)17(15)25)21-18(24)27-11-13-7-5-6-8-14(13)20/h5-8,12H,9-11H2,1-4H3
InChIKey
GIXFUATVNPHHIG-UHFFFAOYSA-N
Synonyms
489396-52-3
489396523
8((2chlorobenzyl)sulfanyl)13dimethyl7(3methylbutyl)37dihydro1Hpurine26dione
8((2chlorobenzyl)thio)7isopentyl13dimethyl1Hpurine26(3H7H)dione
8((2CHLOROPHENYL)METHYLSULFANYL)13DIMETHYL7(3METHYLBUTYL)PURINE26DIONE
CC(C)CCN1C2=C(N=C1SCC3=CC=CC=C3Cl)N(C(=O)N(C2=O)C)C
InChI=1SC19H23ClN4O2Sc112(2)910241516(22(3)19(26)23(4)17(15)25)2118(24)271113756814(13)20h5812H911H214H3
MFCD03295469
ZINC000013583437
ZINC13583437

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Available files

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