N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[4-(2-methylbutan-2-yl)phenoxy]ethanamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[4-(2-methylbutan-2-yl)phenoxy]ethanamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[4-(1,1-dimethylpropyl)phenoxy]acetamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-2-[4-(2-methylbutan-2-yl)phenoxy]acetamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-2-[4-(2-methylbutan-2-yl)phenoxy]acetamide Traditional Name: 2-(4-tert-amylphenoxy)-N-[4-(azepan-1-ylsulfonyl)phenyl]acetamide Formula: C25H34N2O4S MolecularWeight: 458.61346

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C25H34N2O4S/c1-4-25(2,3)20-9-13-22(14-10-20)31-19-24(28)26-21-11-15-23(16-12-21)32(29,30)27-17-7-5-6-8-18-27/h9-16H,4-8,17-19H2,1-3H3,(H,26,28)