Vitas-M small molecule compound

N-cyclopropyl-1-(6-{[2-oxo-2-(piperidin-1-yl)ethyl]sulfanyl}pyrimidin-4-yl)-1H-pyrazole-3-carboxamide

Catalog ID
STL092884
SMILES O=C(N1CCCCC1)CSc1ncnc(c1)n1ccc(n1)C(=O)NC1CC1

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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 C18H22N6O2S MW 386.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N6O2S/c25-17(23-7-2-1-3-8-23)11-27-16-10-15(19-12-20-16)24-9-6-14(22-24)18(26)21-13-4-5-13/h6,9-10,12-13H,1-5,7-8,11H2,(H,21,26)
InChIKey
HHPMOQBQNKOTRK-UHFFFAOYSA-N
Synonyms

C1CCN(CC1)C(=O)CSC2=NC=NC(=C2)N3C=CC(=N3)C(=O)NC4CC4
InChI=1SC18H22N6O2Sc2517(237213823)1127161015(19122016)249614(2224)18(26)21134513h69101213H157811H2(H2126)
MFCD18787087
Ncyclopropyl1(6((2oxo2(piperidin1yl)ethyl)sulfanyl)pyrimidin4yl)1Hpyrazole3carboxamide
Ncyclopropyl1(6(2oxo2piperidin1ylethyl)sulfanylpyrimidin4yl)pyrazole3carboxamide
ZINC000067225652
ZINC67225652

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Available files

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