Vitas-M small molecule compound

N-(4-bromophenyl)-2-[(4-cyano-1-phenyl-5,6,7,8-tetrahydroisoquinolin-3-yl)sulfanyl]acetamide

Catalog ID
STK870565
SMILES N#Cc1c(SCC(=O)Nc2ccc(cc2)Br)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 C24H20BrN3OS MW 478.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H20BrN3OS/c25-17-10-12-18(13-11-17)27-22(29)15-30-24-21(14-26)19-8-4-5-9-20(19)23(28-24)16-6-2-1-3-7-16/h1-3,6-7,10-13H,4-5,8-9,15H2,(H,27,29)
InChIKey
ACSAJXQQILEWAS-UHFFFAOYSA-N
Synonyms

C1CCC2=C(N=C(C(=C2C1)C#N)SCC(=O)NC3=CC=C(C=C3)Br)C4=CC=CC=C4
InChI=1SC24H20BrN3OSc2517101218(131117)2722(29)15302421(1426)19845920(19)23(2824)166213716h13671013H458915H2(H2729)
MFCD02328708
N(4bromophenyl)2((4cyano1phenyl5678tetrahydroisoquinolin3yl)sulfanyl)acetamide
N(4bromophenyl)2((4cyano1phenyl5678tetrahydroisoquinolin3yl)thio)acetamide
ZINC000008768995
ZINC08768995
ZINC8768995

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Available files

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