Vitas-M small molecule compound

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

Catalog ID
STK721200
SMILES CCCCCNc1nc(CCCC)c2c(c1C#N)CCCC2

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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 C19H29N3 MW 299.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H29N3/c1-3-5-9-13-21-19-17(14-20)15-10-7-8-11-16(15)18(22-19)12-6-4-2/h3-13H2,1-2H3,(H,21,22)
InChIKey
PSVAGDACHUWMDK-UHFFFAOYSA-N
Synonyms
371940-97-5
1butyl3(pentylamino)5678tetrahydroisoquinoline4carbonitrile
371940975
CCCCCNC1=NC(=C2CCCCC2=C1C#N)CCCC
InChI=1SC19H29N3c135913211917(1420)1510781116(15)18(2219)12642h313H212H3(H2122)
MFCD01562791
ZINC000020827470
ZINC20827470

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Available files

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