Vitas-M small molecule compound

N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-[4-(2-methoxyphenyl)piperazin-1-yl]acetamide

Catalog ID
STL509470
SMILES COc1ccccc1N1CCN(CC1)CC(=O)Nc1sc2c(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 C22H26N4O2S MW 410.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O2S/c1-28-19-8-4-3-7-18(19)26-12-10-25(11-13-26)15-21(27)24-22-17(14-23)16-6-2-5-9-20(16)29-22/h3-4,7-8H,2,5-6,9-13,15H2,1H3,(H,24,27)
InChIKey
VFYIJHKJJFEAAG-UHFFFAOYSA-N
Synonyms

~(N)(3cyano4567tetrahydro1benzothiophen2yl)2(4(2methoxyphenyl)piperazin1yl)acetamide
1080999
InChI=1SC22H26N4O2Sc12819843718(19)26121025(111326)1521(27)242217(1423)16625920(16)2922h3478H25691315H21H3(H2427)
MFCD04873577
N(3cyano4567tetrahydro1benzothiophen2yl)2(4(2methoxyphenyl)piperazin1yl)acetamide
ZINC000036408745
ZINC36408745

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Available files

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