Vitas-M small molecule compound

3-[(3-methylbutyl)amino]-1-phenyl-5,6,7,8-tetrahydroisoquinoline-4-carbonitrile

Catalog ID
STK525751
SMILES N#Cc1c(NCCC(C)C)nc(c2c1CCCC2)c1ccccc1

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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 C21H25N3 MW 319.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N3/c1-15(2)12-13-23-21-19(14-22)17-10-6-7-11-18(17)20(24-21)16-8-4-3-5-9-16/h3-5,8-9,15H,6-7,10-13H2,1-2H3,(H,23,24)
InChIKey
GYGJRSMYCAAGDY-UHFFFAOYSA-N
Synonyms
371199-26-7
3((3methylbutyl)amino)1phenyl5678tetrahydroisoquinoline4carbonitrile
3(3methylbutylamino)1phenyl5678tetrahydroisoquinoline4carbonitrile
3(isopentylamino)1phenyl5678tetrahydroisoquinoline4carbonitrile
371199267
CC(C)CCNC1=NC(=C2CCCCC2=C1C#N)C3=CC=CC=C3
InChI=1SC21H25N3c115(2)1213232119(1422)1710671118(17)20(2421)168435916h358915H671013H212H3(H2324)
MFCD01563768
ZINC000020827597
ZINC20827597

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Available files

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