Vitas-M small molecule compound
8-[(3-bromobenzyl)sulfanyl]-7-[3-(4-chlorophenoxy)-2-hydroxypropyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK015813
SMILES OC(Cn1c(SCc2cccc(c2)Br)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 C22H20BrClN4O4S MW 551.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20BrClN4O4S/c1-27-19-18(20(30)26-21(27)31)28(10-16(29)11-32-17-7-5-15(24)6-8-17)22(25-19)33-12-13-3-2-4-14(23)9-13/h2-9,16,29H,10-12H2,1H3,(H,26,30,31)InChIKey
SJFOAFSQCPUYNG-UHFFFAOYSA-NSynonyms
8((3BROMOBENZYL)SULFANYL)7(3(4CHLOROPHENOXY)2HYDROXYPROPYL)3METHYL37DIHYDRO1HPURINE26DIONE
8((3bromobenzyl)thio)7(3(4chlorophenoxy)2hydroxypropyl)3methyl1Hpurine26(3H7H)dione
8((3BROMOPHENYL)METHYLSULFANYL)7(3(4CHLOROPHENOXY)2HYDROXYPROPYL)3METHYLPURINE26DIONE
8((3BROMOPHENYL)METHYLTHIO)7(3(4CHLOROPHENOXY)2HYDROXYPROPYL)3METHYL137TRIHYDROPURINE26DIONE
CN1C2=C(C(=O)NC1=O)N(C(=N2)SCC3=CC(=CC=C3)Br)CC(COC4=CC=C(C=C4)Cl)O
InChI=1SC22H20BrClN4O4Sc1271918(20(30)2621(27)31)28(1016(29)1132177515(24)6817)22(2519)33121332414(23)913h291629H1012H21H3(H263031)
MFCD01079312
OC(Cn1c(SCc2cccc(c2)Br)nc2c1c(=O)(nH)c(=O)n2C)COc1ccc(cc1)Cl
STK015813
ZINC000017779826
ZINC000018090189
Check stock
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Check stock on Vitas-MAvailable files
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