N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-cyano-2-ethoxy-phenoxy)ethanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-cyano-2-ethoxy-phenoxy)ethanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-cyano-2-ethoxy-phenoxy)acetamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-2-(4-cyano-2-ethoxyphenoxy)acetamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-cyano-2-ethoxyphenoxy)acetamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-2-(4-cyano-2-ethoxy-phenoxy)acetamide Formula: C23H27N3O5S MolecularWeight: 457.54258

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C#N)OCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CCOC1=C(C=CC(=C1)C#N)OCC(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C23H27N3O5S/c1-2-30-22-14-18(16-24)10-11-21(22)31-17-23(27)25-19-8-7-9-20(15-19)32(28,29)26-12-5-3-4-6-13-26/h7-11,14-15H,2-6,12-13,17H2,1H3,(H,25,27)