Vitas-M small molecule compound

2-[(3-methyl-2,6-dioxo-7-pentyl-2,3,6,7-tetrahydro-1H-purin-8-yl)sulfanyl]-N-phenylacetamide

Catalog ID
STK834360
SMILES CCCCCn1c(SCC(=O)Nc2ccccc2)nc2c1c(=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 C19H23N5O3S MW 401.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N5O3S/c1-3-4-8-11-24-15-16(23(2)18(27)22-17(15)26)21-19(24)28-12-14(25)20-13-9-6-5-7-10-13/h5-7,9-10H,3-4,8,11-12H2,1-2H3,(H,20,25)(H,22,26,27)
InChIKey
QOKRXJANAYLSNH-UHFFFAOYSA-N
Synonyms
301354-10-9
2((3methyl26dioxo7pentyl2367tetrahydro1Hpurin8yl)sulfanyl)Nphenylacetamide
2((3methyl26dioxo7pentyl2367tetrahydro1Hpurin8yl)thio)Nphenylacetamide
2(3METHYL26DIOXO7PENTYL(137TRIHYDROPURIN8YLTHIO))NPHENYLACETAMIDE
2(3METHYL26DIOXO7PENTYLPURIN8YL)SULFANYLNPHENYLACETAMIDE
301354109
CCCCCn1c(SCC(=O)Nc2ccccc2)nc2c1c(=O)(nH)c(=O)n2C
CCCCCN1C2=C(N=C1SCC(=O)NC3=CC=CC=C3)N(C(=O)NC2=O)C
InChI=1SC19H23N5O3Sc134811241516(23(2)18(27)2217(15)26)2119(24)281214(25)201396571013h57910H3481112H212H3(H2025)(H222627)
MFCD00612600
ZINC000003209458
ZINC03209458
ZINC3209458

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Available files

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