Vitas-M small molecule compound

3-methyl-7-(2-methylprop-2-en-1-yl)-8-[(2-phenylethyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK834038
SMILES CC(=C)Cn1c(SCCc2ccccc2)nc2c1c(=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 C18H20N4O2S MW 356.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H20N4O2S/c1-12(2)11-22-14-15(21(3)17(24)20-16(14)23)19-18(22)25-10-9-13-7-5-4-6-8-13/h4-8H,1,9-11H2,2-3H3,(H,20,23,24)
InChIKey
IKRFGXFSCITENU-UHFFFAOYSA-N
Synonyms
332098-78-9
332098789
3methyl7(2methylallyl)8(phenethylthio)1Hpurine26(3H7H)dione
3METHYL7(2METHYLALLYL)8PHENETHYLSULFANYL37DIHYDROPURINE26DIONE
3methyl7(2methylprop2en1yl)8((2phenylethyl)sulfanyl)37dihydro1Hpurine26dione
3methyl7(2methylprop2enyl)8(2phenylethylsulfanyl)purine26dione
3METHYL7(2METHYLPROP2ENYL)8(2PHENYLETHYLTHIO)137TRIHYDROPURINE26DIONE
3METHYL7(2METHYLPROP2ENYL)8PHENETHYLSULFANYLPURINE26DIONE
CC(=C)Cn1c(SCCc2ccccc2)nc2c1c(=O)(nH)c(=O)n2C
CC(=C)CN1C2=C(N=C1SCCC3=CC=CC=C3)N(C(=O)NC2=O)C
InChI=1SC18H20N4O2Sc112(2)11221415(21(3)17(24)2016(14)23)1918(22)25109137546813h48H1911H223H3(H202324)
MFCD01879773
ZINC000000633024
ZINC00633024
ZINC633024

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Available files

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