Vitas-M small molecule compound

2-(7H-purin-6-ylsulfanyl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)propanamide

Catalog ID
STK628211
SMILES O=C(C(Sc1ncnc2c1[nH]cn2)C)NC1CCCc2c1cccc2

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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 C18H19N5OS MW 353.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N5OS/c1-11(25-18-15-16(20-9-19-15)21-10-22-18)17(24)23-14-8-4-6-12-5-2-3-7-13(12)14/h2-3,5,7,9-11,14H,4,6,8H2,1H3,(H,23,24)(H,19,20,21,22)
InChIKey
WEZMQMDORRVDJA-UHFFFAOYSA-N
Synonyms
929831-95-8
2((9Hpurin6yl)thio)N(1234tetrahydronaphthalen1yl)propanamide
2(7Hpurin6ylsulfanyl)N(1234tetrahydronaphthalen1yl)propanamide
929831958
CC(C(=O)NC1CCCC2=CC=CC=C12)SC3=NC=NC4=C3NC=N4
InChI=1SC18H19N5OSc111(25181516(2091915)21102218)17(24)231484612523713(12)14h235791114H468H21H3(H2324)(H19202122)
MFCD09794634
ZINC000008991905
ZINC000008991908

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Available files

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