Vitas-M small molecule compound

N-benzyl-4-(4-cyano-1-methyl-5,6,7,8-tetrahydroisoquinolin-3-yl)piperazine-1-carbothioamide

Catalog ID
STK615021
SMILES N#Cc1c(nc(c2c1CCCC2)C)N1CCN(CC1)C(=S)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 C23H27N5S MW 405.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N5S/c1-17-19-9-5-6-10-20(19)21(15-24)22(26-17)27-11-13-28(14-12-27)23(29)25-16-18-7-3-2-4-8-18/h2-4,7-8H,5-6,9-14,16H2,1H3,(H,25,29)
InChIKey
OZGFSXZNIOGOME-UHFFFAOYSA-N
Synonyms
903585-70-6
903585706
CC1=C2CCCCC2=C(C(=N1)N3CCN(CC3)C(=S)NCC4=CC=CC=C4)C#N
InChI=1SC23H27N5Sc117199561020(19)21(1524)22(2617)27111328(141227)23(29)2516187324818h2478H5691416H21H3(H2529)
MFCD08292821
Nbenzyl4(4cyano1methyl5678tetrahydroisoquinolin3yl)piperazine1carbothioamide
ZINC000020591440
ZINC20591440

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Available files

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