Vitas-M small molecule compound

azepan-1-yl[5-(2,3-dihydro-1H-indol-1-ylsulfonyl)-2-methoxyphenyl]methanone

Catalog ID
STK344302
SMILES COc1ccc(cc1C(=O)N1CCCCCC1)S(=O)(=O)N1CCc2c1cccc2

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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 C22H26N2O4S MW 414.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2O4S/c1-28-21-11-10-18(16-19(21)22(25)23-13-6-2-3-7-14-23)29(26,27)24-15-12-17-8-4-5-9-20(17)24/h4-5,8-11,16H,2-3,6-7,12-15H2,1H3
InChIKey
ADZSDTIXUQWCCF-UHFFFAOYSA-N
Synonyms

azepan1yl(5(23dihydro1Hindol1ylsulfonyl)2methoxyphenyl)methanone
azepan1yl(5(23dihydroindol1ylsulfonyl)2methoxyphenyl)methanone
COC1=C(C=C(C=C1)S(=O)(=O)N2CCC3=CC=CC=C32)C(=O)N4CCCCCC4
InChI=1SC22H26N2O4Sc12821111018(1619(21)22(25)231362371423)29(2627)24151217845920(17)24h4581116H23671215H21H3
MFCD09676744
ZINC000008181484
ZINC08181484
ZINC8181484

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Available files

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