Vitas-M small molecule compound

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

Catalog ID
STK842427
SMILES OCCCSc1nc2c(n1Cc1ccccc1Cl)c(=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 C17H19ClN4O3S MW 394.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19ClN4O3S/c1-20-14-13(15(24)21(2)17(20)25)22(16(19-14)26-9-5-8-23)10-11-6-3-4-7-12(11)18/h3-4,6-7,23H,5,8-10H2,1-2H3
InChIKey
GIAPQSNCTCTTML-UHFFFAOYSA-N
Synonyms
442865-01-2
442865012
7((2CHLOROPHENYL)METHYL)8(3HYDROXYPROPYLSULFANYL)13DIMETHYLPURINE26DIONE
7((2CHLOROPHENYL)METHYL)8(3HYDROXYPROPYLTHIO)13DIMETHYL137TRIHYDROPURINE26DIONE
7(2chlorobenzyl)8((3hydroxypropyl)sulfanyl)13dimethyl37dihydro1Hpurine26dione
7(2CHLOROBENZYL)8((3HYDROXYPROPYL)THIO)13DIMETHYL1HPURINE26(3H7H)DIONE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)SCCCO)CC3=CC=CC=C3Cl
InChI=1SC17H19ClN4O3Sc1201413(15(24)21(2)17(20)25)22(16(1914)2695823)1011634712(11)18h346723H5810H212H3
MFCD03417383
ZINC000001830544
ZINC01830544
ZINC1830544

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Available files

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