Vitas-M small molecule compound
8-(butylsulfanyl)-3-methyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK806232
SMILES CCCCSc1nc2c(n1Cc1cccc(c1)C)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 C18H22N4O2S MW 358.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4O2S/c1-4-5-9-25-18-19-15-14(16(23)20-17(24)21(15)3)22(18)11-13-8-6-7-12(2)10-13/h6-8,10H,4-5,9,11H2,1-3H3,(H,20,23,24)InChIKey
NGIUVMJYRRMKOY-UHFFFAOYSA-NSynonyms
303973-49-1303973491
8(butylsulfanyl)3methyl7(3methylbenzyl)37dihydro1Hpurine26dione
8(butylthio)3methyl7(3methylbenzyl)1Hpurine26(3H7H)dione
8BUTYLSULFANYL3METHYL7((3METHYLPHENYL)METHYL)PURINE26DIONE
8BUTYLSULFANYL3METHYL7(3METHYLBENZYL)37DIHYDROPURINE26DIONE
8BUTYLTHIO3METHYL7((3METHYLPHENYL)METHYL)137TRIHYDROPURINE26DIONE
CCCCSC1=NC2=C(N1CC3=CC=CC(=C3)C)C(=O)NC(=O)N2C
CCCCSc1nc2c(n1Cc1cccc(c1)C)c(=O)(nH)c(=O)n2C
InChI=1SC18H22N4O2Sc14592518191514(16(23)2017(24)21(15)3)22(18)111386712(2)1013h6810H45911H213H3(H202324)
MFCD01186379
ZINC000002060835
ZINC02060835
ZINC2060835
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