Vitas-M small molecule compound

2-propanoyl-1,2,3,4-tetrahydroisoquinoline-1-carbonitrile

Catalog ID
STK365734
SMILES N#CC1N(CCc2c1cccc2)C(=O)CC

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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 C13H14N2O MW 214.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N2O/c1-2-13(16)15-8-7-10-5-3-4-6-11(10)12(15)9-14/h3-6,12H,2,7-8H2,1H3
InChIKey
LGQXFHDNYCTHHE-UHFFFAOYSA-N
Synonyms

2propanoyl1234tetrahydroisoquinoline1carbonitrile
2PROPANOYL34DIHYDRO1HISOQUINOLINE1CARBONITRILE
CCC(=O)N1CCC2=CC=CC=C2C1C#N
InChI=1SC13H14N2Oc1213(16)158710534611(10)12(15)914h3612H278H21H3
MFCD00458625
ZINC000000477291
ZINC000000477292

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Available files

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