Vitas-M small molecule compound
7-(2-chlorobenzyl)-3-methyl-8-(methylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK835097
SMILES CSc1nc2c(n1Cc1ccccc1Cl)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 C14H13ClN4O2S MW 336.80 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H13ClN4O2S/c1-18-11-10(12(20)17-13(18)21)19(14(16-11)22-2)7-8-5-3-4-6-9(8)15/h3-6H,7H2,1-2H3,(H,17,20,21)InChIKey
NIOIYFXNDLMKTL-UHFFFAOYSA-NSynonyms
313380-53-9313380539
7((2CHLOROPHENYL)METHYL)3METHYL8METHYLSULFANYLPURINE26DIONE
7(2chlorobenzyl)3methyl8(methylsulfanyl)37dihydro1Hpurine26dione
7(2CHLOROBENZYL)3METHYL8(METHYLTHIO)1HPURINE26(3H7H)DIONE
7(2CHLOROBENZYL)3METHYL8METHYLSULFANYL37DIHYDROPURINE26DIONE
CN1C2=C(C(=O)NC1=O)N(C(=N2)SC)CC3=CC=CC=C3Cl
CSc1nc2c(n1Cc1ccccc1Cl)c(=O)(nH)c(=O)n2C
InChI=1SC14H13ClN4O2Sc1181110(12(20)1713(18)21)19(14(1611)222)7853469(8)15h36H7H212H3(H172021)
MFCD01051700
ZINC000000180807
ZINC00180807
ZINC180807
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