Vitas-M small molecule compound

1,3,7-trimethyl-8-[(1H-tetrazol-5-ylmethyl)sulfanyl]-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STL378454
SMILES Cn1c(SCc2nnn[nH]2)nc2c1c(=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 C10H12N8O2S MW 308.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H12N8O2S/c1-16-6-7(17(2)10(20)18(3)8(6)19)11-9(16)21-4-5-12-14-15-13-5/h4H2,1-3H3,(H,12,13,14,15)
InChIKey
ZCWKNFRDBQAPJO-UHFFFAOYSA-N
Synonyms

137trimethyl8((1Htetrazol5ylmethyl)sulfanyl)37dihydro1Hpurine26dione
137TRIMETHYL8((2HTETRAZOL5YLMETHYL)SULFANYL)37DIHYDRO1HPURINE26DIONE
137TRIMETHYL8(1HTETRAZOL5YLMETHYLSULFANYL)37DIHYDROPURINE26DIONE
137TRIMETHYL8(2HTETRAZOL5YLMETHYLSULFANYL)PURINE26DIONE
Cn1c(SCc2nnn(nH)2)nc2c1c(=O)n(c(=O)n2C)C
CN1C2=C(N=C1SCC3=NNN=N3)N(C(=O)N(C2=O)C)C
InChI=1SC10H12N8O2Sc11667(17(2)10(20)18(3)8(6)19)119(16)2145121415135h4H213H3(H12131415)
MFCD01871024
ZINC000004396149
ZINC4396149

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Available files

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