Vitas-M small molecule compound
7-(2-hydroxy-3-phenoxypropyl)-3-methyl-8-(propylsulfanyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK528308
SMILES CCCSc1nc2c(n1CC(COc1ccccc1)O)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 C18H22N4O4S MW 390.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4O4S/c1-3-9-27-18-19-15-14(16(24)20-17(25)21(15)2)22(18)10-12(23)11-26-13-7-5-4-6-8-13/h4-8,12,23H,3,9-11H2,1-2H3,(H,20,24,25)InChIKey
HVLYEEOXSFNGLW-UHFFFAOYSA-NSynonyms
331675-48-0331675480
7(2hydroxy3phenoxypropyl)3methyl8(propylsulfanyl)37dihydro1Hpurine26dione
7(2hydroxy3phenoxypropyl)3methyl8(propylthio)1Hpurine26(3H7H)dione
7(2HYDROXY3PHENOXYPROPYL)3METHYL8PROPYLSULFANYL37DIHYDROPURINE26DIONE
7(2HYDROXY3PHENOXYPROPYL)3METHYL8PROPYLSULFANYLPURINE26DIONE
CCCSC1=NC2=C(N1CC(COC3=CC=CC=C3)O)C(=O)NC(=O)N2C
CCCSc1nc2c(n1CC(COc1ccccc1)O)c(=O)(nH)c(=O)n2C
InChI=1SC18H22N4O4Sc1392718191514(16(24)2017(25)21(15)2)22(18)1012(23)1126137546813h481223H3911H212H3(H202425)
MFCD00809891
ZINC000003109210
ZINC000037868868
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