Vitas-M small molecule compound

3-(azepan-1-ylsulfonyl)-4-methyl-N-[2-(propan-2-ylcarbamoyl)phenyl]benzamide

Catalog ID
STK246681
SMILES CC(NC(=O)c1ccccc1NC(=O)c1ccc(c(c1)S(=O)(=O)N1CCCCCC1)C)C

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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 C24H31N3O4S MW 457.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H31N3O4S/c1-17(2)25-24(29)20-10-6-7-11-21(20)26-23(28)19-13-12-18(3)22(16-19)32(30,31)27-14-8-4-5-9-15-27/h6-7,10-13,16-17H,4-5,8-9,14-15H2,1-3H3,(H,25,29)(H,26,28)
InChIKey
LJEIEUSOMJTDRZ-UHFFFAOYSA-N
Synonyms

3(azepan1ylsulfonyl)4methylN(2(propan2ylcarbamoyl)phenyl)benzamide
CC1=C(C=C(C=C1)C(=O)NC2=CC=CC=C2C(=O)NC(C)C)S(=O)(=O)N3CCCCCC3
InChI=1SC24H31N3O4Sc117(2)2524(29)2010671121(20)2623(28)19131218(3)22(1619)32(3031)271484591527h6710131617H45891415H213H3(H2529)(H2628)
MFCD08683201
ZINC000009667754
ZINC09667754
ZINC9667754

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Available files

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