Vitas-M small molecule compound

8-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]-1,3,9-trimethyl-3,9-dihydro-1H-purine-2,6-dione

Catalog ID
STK522303
SMILES Cc1oc(nc1C)Sc1nc2c(n1C)n(C)c(=O)n(c2=O)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 C13H15N5O3S MW 321.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15N5O3S/c1-6-7(2)21-12(14-6)22-11-15-8-9(16(11)3)17(4)13(20)18(5)10(8)19/h1-5H3
InChIKey
UMKCCKPBEIQVNB-UHFFFAOYSA-N
Synonyms
948263-87-4
8((45dimethyl13oxazol2yl)sulfanyl)139trimethyl39dihydro1Hpurine26dione
8((45dimethyl13oxazol2yl)sulfanyl)139trimethylpurine26dione
8((45dimethyloxazol2yl)thio)139trimethyl1Hpurine26(3H9H)dione
948263874
CC1=C(OC(=N1)SC2=NC3=C(N2C)N(C(=O)N(C3=O)C)C)C
InChI=1SC13H15N5O3Sc167(2)2112(146)22111589(16(11)3)17(4)13(20)18(5)10(8)19h15H3
MFCD11696013
ZINC000009146159
ZINC09146159
ZINC9146159

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.