Vitas-M small molecule compound
7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-3-methyl-8-[(3-methylbutyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL003696
SMILES OC(Cn1c(SCCC(C)C)nc2c1c(=O)[nH]c(=O)n2C)COc1ccc(cc1)Cl
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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 C20H25ClN4O4S MW 452.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H25ClN4O4S/c1-12(2)8-9-30-20-22-17-16(18(27)23-19(28)24(17)3)25(20)10-14(26)11-29-15-6-4-13(21)5-7-15/h4-7,12,14,26H,8-11H2,1-3H3,(H,23,27,28)InChIKey
BMYOVTIFCQESIH-UHFFFAOYSA-NSynonyms
330179-59-4330179594
7((2R)3(4CHLOROPHENOXY)2HYDROXYPROPYL)3METHYL8((3METHYLBUTYL)SULFANYL)37DIHYDRO1HPURINE26DIONE
7((2S)3(4CHLOROPHENOXY)2HYDROXYPROPYL)3METHYL8((3METHYLBUTYL)SULFANYL)37DIHYDRO1HPURINE26DIONE
7(3(4chlorophenoxy)2hydroxypropyl)3methyl8((3methylbutyl)sulfanyl)37dihydro1Hpurine26dione
7(3(4CHLOROPHENOXY)2HYDROXYPROPYL)3METHYL8(3METHYLBUTYLSULFANYL)PURINE26DIONE
7(3(4CHLOROPHENOXY)2HYDROXYPROPYL)8(ISOPENTYLTHIO)3METHYL1HPURINE26(3H7H)DIONE
CC(C)CCSC1=NC2=C(N1CC(COC3=CC=C(C=C3)Cl)O)C(=O)NC(=O)N2C
InChI=1SC20H25ClN4O4Sc112(2)893020221716(18(27)2319(28)24(17)3)25(20)1014(26)1129156413(21)5715h47121426H811H213H3(H232728)
MFCD00754456
OC(Cn1c(SCCC(C)C)nc2c1c(=O)(nH)c(=O)n2C)COc1ccc(cc1)Cl
ZINC000001009512
Check stock
See real-time availability and sample size for STL003696 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
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