N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(4-cyano-2-ethoxy-phenoxy)ethanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(4-cyano-2-ethoxy-phenoxy)ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(4-cyano-2-ethoxy-phenoxy)acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-2-(4-cyano-2-ethoxyphenoxy)acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2-(4-cyano-2-ethoxyphenoxy)acetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-(4-cyano-2-ethoxy-phenoxy)acetamide Formula: C24H29N3O6S MolecularWeight: 487.56856

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H29N3O6S/c1-3-32-23-14-18(16-25)8-10-22(23)33-17-24(28)26-20-15-19(9-11-21(20)31-2)34(29,30)27-12-6-4-5-7-13-27/h8-11,14-15H,3-7,12-13,17H2,1-2H3,(H,26,28)