Vitas-M small molecule compound

N-benzyl-2-{4-[4-cyano-1-(furan-2-yl)-5,6,7,8-tetrahydroisoquinolin-3-yl]piperazin-1-yl}-2-oxoacetamide

Catalog ID
STK629155
SMILES N#Cc1c(nc(c2c1CCCC2)c1ccco1)N1CCN(CC1)C(=O)C(=O)NCc1ccccc1

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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 C27H27N5O3 MW 469.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H27N5O3/c28-17-22-20-9-4-5-10-21(20)24(23-11-6-16-35-23)30-25(22)31-12-14-32(15-13-31)27(34)26(33)29-18-19-7-2-1-3-8-19/h1-3,6-8,11,16H,4-5,9-10,12-15,18H2,(H,29,33)
InChIKey
FZOWWGFAPFGMHW-UHFFFAOYSA-N
Synonyms
921041-83-0
921041830
C1CCC2=C(N=C(C(=C2C1)C#N)N3CCN(CC3)C(=O)C(=O)NCC4=CC=CC=C4)C5=CC=CO5
InChI=1SC27H27N5O3c281722209451021(20)24(23116163523)3025(22)31121432(151331)27(34)26(33)2918197213819h13681116H45910121518H2(H2933)
MFCD08743704
Nbenzyl2(4(4cyano1(furan2yl)5678tetrahydroisoquinolin3yl)piperazin1yl)2oxoacetamide
ZINC000020591799
ZINC20591799

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Available files

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