Vitas-M small molecule compound

N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(3,4-dihydroisoquinolin-2(1H)-yl)acetamide

Catalog ID
STL509455
SMILES N#Cc1c(NC(=O)CN2CCc3c(C2)cccc3)sc2c1CCCC2

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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 C20H21N3OS MW 351.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3OS/c21-11-17-16-7-3-4-8-18(16)25-20(17)22-19(24)13-23-10-9-14-5-1-2-6-15(14)12-23/h1-2,5-6H,3-4,7-10,12-13H2,(H,22,24)
InChIKey
JSOFSMYMJNFFMT-UHFFFAOYSA-N
Synonyms
736187-78-3
~(N)(3cyano4567tetrahydro1benzothiophen2yl)2(34dihydro1~(H)isoquinolin2yl)acetamide
2242884
736187783
InChI=1SC20H21N3OSc21111716734818(16)2520(17)2219(24)132310914512615(14)1223h1256H347101213H2(H2224)
MFCD04608267
N(3cyano4567tetrahydro1benzothiophen2yl)2(34dihydroisoquinolin2(1H)yl)acetamide
ZINC000036858951
ZINC36858951

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Available files

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