Vitas-M small molecule compound

1-butyl-3-(piperidin-1-yl)-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Catalog ID
STK830082
SMILES CCCCc1nc(N2CCCCC2)c(c2c1CCCC2)C#N

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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 C19H27N3 MW 297.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H27N3/c1-2-3-11-18-16-10-6-5-9-15(16)17(14-20)19(21-18)22-12-7-4-8-13-22/h2-13H2,1H3
InChIKey
NYEFMWIMPFKBPZ-UHFFFAOYSA-N
Synonyms
371935-47-6
1butyl3(piperidin1yl)5678tetrahydroisoquinoline4carbonitrile
1butyl3piperidin1yl5678tetrahydroisoquinoline4carbonitrile
371935476
CCCCC1=C2CCCCC2=C(C(=N1)N3CCCCC3)C#N
InChI=1SC19H27N3c1231118161065915(16)17(1420)19(2118)22127481322h213H21H3
MFCD01562387
ZINC000020827405
ZINC20827405

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Available files

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