Vitas-M small molecule compound

3-methyl-7-[2-oxo-2-(thiophen-2-yl)ethyl]-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STL228970
SMILES O=C(c1cccs1)Cn1cnc2c1c(=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 C12H10N4O3S MW 290.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10N4O3S/c1-15-10-9(11(18)14-12(15)19)16(6-13-10)5-7(17)8-3-2-4-20-8/h2-4,6H,5H2,1H3,(H,14,18,19)
InChIKey
HBLQZVLUCTVIAK-UHFFFAOYSA-N
Synonyms

3methyl7(2oxo2(thiophen2yl)ethyl)37dihydro1Hpurine26dione
3METHYL7(2OXO2THIOPHEN2YLETHYL)PURINE26DIONE
CN1C2=C(C(=O)NC1=O)N(C=N2)CC(=O)C3=CC=CS3
InChI=1SC12H10N4O3Sc115109(11(18)1412(15)19)16(61310)57(17)8324208h246H5H21H3(H141819)
MFCD06643582
O=C(c1cccs1)Cn1cnc2c1c(=O)(nH)c(=O)n2C
ZINC000008048425
ZINC08048425
ZINC8048425

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Available files

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