Vitas-M small molecule compound

7-[2-hydroxy-3-(naphthalen-1-yloxy)propyl]-3-methyl-8-[(3-methylbutyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK058940
SMILES OC(Cn1c(SCCC(C)C)nc2c1c(=O)[nH]c(=O)n2C)COc1cccc2c1cccc2

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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 C24H28N4O4S MW 468.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N4O4S/c1-15(2)11-12-33-24-25-21-20(22(30)26-23(31)27(21)3)28(24)13-17(29)14-32-19-10-6-8-16-7-4-5-9-18(16)19/h4-10,15,17,29H,11-14H2,1-3H3,(H,26,30,31)
InChIKey
SCEXCFASYAWFHM-UHFFFAOYSA-N
Synonyms
303970-67-4
6HYDROXY7(2HYDROXY3(NAPHTHALEN1YLOXY)PROPYL)3METHYL8((3METHYLBUTYL)SULFANYL)37DIHYDRO2HPURIN2ONE
7(2HYDROXY3(NAPHTHALEN1YLOXY)PROPYL)3METHYL8((3METHYLBUTYL)SULFANYL)37DIHYDRO1HPURINE26DIONE
7(2hydroxy3(naphthalen1yloxy)propyl)8(isopentylthio)3methyl1Hpurine26(3H7H)dione
7(2HYDROXY3NAPHTHALEN1YLOXYPROPYL)3METHYL8(3METHYLBUTYLSULFANYL)PURINE26DIONE
7(2HYDROXY3NAPHTHYLOXYPROPYL)3METHYL8(3METHYLBUTYLTHIO)137TRIHYDROPURINE26DIONE
CC(C)CCSC1=NC2=C(N1CC(COC3=CC=CC4=CC=CC=C43)O)C(=O)NC(=O)N2C
InChI=1SC24H28N4O4Sc115(2)11123324252120(22(30)2623(31)27(21)3)28(24)1317(29)143219106816745918(16)19h410151729H1114H213H3(H263031)
MFCD01554066
OC(Cn1c(SCCC(C)C)nc2c1c(=O)(nH)c(=O)n2C)COc1cccc2c1cccc2
STK058940
ZINC000000850081
ZINC000000850082

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Available files

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