Vitas-M small molecule compound

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

Catalog ID
STK838004
SMILES CC(=C)CSc1nc2c(n1Cc1ccccc1)c(=O)n(c(=O)n2C)C

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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)11-25-17-19-15-14(16(23)21(4)18(24)20(15)3)22(17)10-13-8-6-5-7-9-13/h5-9H,1,10-11H2,2-4H3
InChIKey
DXBUTSHIXVBMIV-UHFFFAOYSA-N
Synonyms
374696-94-3
13DIMETHYL8(2METHYLPROP2ENYLTHIO)7BENZYL137TRIHYDROPURINE26DIONE
374696943
7benzyl13dimethyl8((2methylallyl)thio)1Hpurine26(3H7H)dione
7benzyl13dimethyl8((2methylprop2en1yl)sulfanyl)37dihydro1Hpurine26dione
7BENZYL13DIMETHYL8(2METHYLALLYLSULFANYL)37DIHYDROPURINE26DIONE
7BENZYL13DIMETHYL8(2METHYLPROP2ENYLSULFANYL)PURINE26DIONE
CC(=C)CSC1=NC2=C(N1CC3=CC=CC=C3)C(=O)N(C(=O)N2C)C
InChI=1SC18H20N4O2Sc112(2)112517191514(16(23)21(4)18(24)20(15)3)22(17)10138657913h59H11011H224H3
MFCD01960632
ZINC000000623302
ZINC00623302
ZINC623302

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Available files

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