Vitas-M small molecule compound

N-[3-(azepan-1-ylcarbonyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-fluorobenzamide

Catalog ID
STK005812
SMILES CC1CCc2c(C1)sc(c2C(=O)N1CCCCCC1)NC(=O)c1ccccc1F

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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 C23H27FN2O2S MW 414.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27FN2O2S/c1-15-10-11-17-19(14-15)29-22(25-21(27)16-8-4-5-9-18(16)24)20(17)23(28)26-12-6-2-3-7-13-26/h4-5,8-9,15H,2-3,6-7,10-14H2,1H3,(H,25,27)
InChIKey
KZGJRHARZWINER-UHFFFAOYSA-N
Synonyms

CC1CCC2=C(C1)SC(=C2C(=O)N3CCCCCC3)NC(=O)C4=CC=CC=C4F
CC1CCc2c(C1)sc(c2C(=O)N1CCCCCC1)NC(=O)c1ccccc1F
InChI=1SC23H27FN2O2Sc11510111719(1415)2922(2521(27)16845918(16)24)20(17)23(28)261262371326h458915H23671014H21H3(H2527)
MFCD02209595
N(3(azepan1ylcarbonyl)6methyl4567tetrahydro1benzothiophen2yl)2fluorobenzamide
N(3(azepane1carbonyl)6methyl4567tetrahydro1benzothiophen2yl)2fluorobenzamide
STK005812
ZINC000001212198
ZINC000001212200

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Available files

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