Vitas-M small molecule compound

2-[(7-hexyl-1,3-dimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]acetamide

Catalog ID
STK840880
SMILES CCCCCCn1c(SCC(=O)N)nc2c1c(=O)n(C)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 C15H23N5O3S MW 353.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H23N5O3S/c1-4-5-6-7-8-20-11-12(17-14(20)24-9-10(16)21)18(2)15(23)19(3)13(11)22/h4-9H2,1-3H3,(H2,16,21)
InChIKey
LDIWTOLZRKTHCM-UHFFFAOYSA-N
Synonyms
385392-57-4
2((7hexyl13dimethyl26dioxo2367tetrahydro1Hpurin8yl)sulfanyl)acetamide
2((7hexyl13dimethyl26dioxo2367tetrahydro1Hpurin8yl)thio)acetamide
2(7HEXYL13DIMETHYL26DIOXOPURIN8YL)SULFANYLACETAMIDE
385392574
CCCCCCN1C2=C(N=C1SCC(=O)N)N(C(=O)N(C2=O)C)C
InChI=1SC15H23N5O3Sc145678201112(1714(20)24910(16)21)18(2)15(23)19(3)13(11)22h49H213H3(H21621)
MFCD03285793
ZINC000001830591
ZINC01830591
ZINC1830591

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Available files

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