Vitas-M small molecule compound
7-(4-chlorobenzyl)-8-[(2-hydroxyethyl)sulfanyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK022225
SMILES OCCSc1nc2c(n1Cc1ccc(cc1)Cl)c(=O)[nH]c(=O)n2C
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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 C15H15ClN4O3S MW 366.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15ClN4O3S/c1-19-12-11(13(22)18-14(19)23)20(15(17-12)24-7-6-21)8-9-2-4-10(16)5-3-9/h2-5,21H,6-8H2,1H3,(H,18,22,23)InChIKey
SEVZXOSCIZUPPR-UHFFFAOYSA-NSynonyms
313470-84-7313470847
7((4CHLOROPHENYL)METHYL)8(2HYDROXYETHYLSULFANYL)3METHYLPURINE26DIONE
7(4CHLOROBENZYL)8((2HYDROXYETHYL)SULFANYL)3METHYL37DIHYDRO1HPURINE26DIONE
7(4CHLOROBENZYL)8((2HYDROXYETHYL)THIO)3METHYL1HPURINE26(3H7H)DIONE
CN1C2=C(C(=O)NC1=O)N(C(=N2)SCCO)CC3=CC=C(C=C3)Cl
InChI=1SC15H15ClN4O3Sc1191211(13(22)1814(19)23)20(15(1712)247621)892410(16)539h2521H68H21H3(H182223)
MFCD01051148
OCCSc1nc2c(n1Cc1ccc(cc1)Cl)c(=O)(nH)c(=O)n2C
STK022225
ZINC000013590323
ZINC13590323
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