Vitas-M small molecule compound

ethyl [4-(4-cyano-1-phenyl-5,6,7,8-tetrahydroisoquinolin-3-yl)piperazin-1-yl](oxo)acetate

Catalog ID
STK628666
SMILES CCOC(=O)C(=O)N1CCN(CC1)c1nc(c2ccccc2)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 C24H26N4O3 MW 418.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N4O3/c1-2-31-24(30)23(29)28-14-12-27(13-15-28)22-20(16-25)18-10-6-7-11-19(18)21(26-22)17-8-4-3-5-9-17/h3-5,8-9H,2,6-7,10-15H2,1H3
InChIKey
FTUYPGDQZHPITM-UHFFFAOYSA-N
Synonyms
921055-77-8
921055778
CCOC(=O)C(=O)N1CCN(CC1)C2=NC(=C3CCCCC3=C2C#N)C4=CC=CC=C4
ethyl(4(4cyano1phenyl5678tetrahydroisoquinolin3yl)piperazin1yl)(oxo)acetate
ethyl2(4(4cyano1phenyl5678tetrahydroisoquinolin3yl)piperazin1yl)2oxoacetate
InChI=1SC24H26N4O3c123124(30)23(29)28141227(131528)2220(1625)1810671119(18)21(2622)178435917h3589H2671015H21H3
MFCD08745425
ZINC000020621624
ZINC20621624

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Available files

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