N-[3-[[3-(azepan-1-ylcarbonyl)-4-methoxy-phenyl]sulfonylamino]phenyl]ethanamide

Systemtic Name: N-[3-[[3-(azepan-1-ylcarbonyl)-4-methoxy-phenyl]sulfonylamino]phenyl]ethanamide Openeye Name: N-[3-[[3-(azepane-1-carbonyl)-4-methoxy-phenyl]sulfonylamino]phenyl]acetamide CAS Name: N-[3-[[3-[1-azepanyl(oxo)methyl]-4-methoxyphenyl]sulfonylamino]phenyl]acetamide IUPAC Name: N-[3-[[3-(azepane-1-carbonyl)-4-methoxyphenyl]sulfonylamino]phenyl]acetamide Traditional Name: N-[3-[[3-(azepane-1-carbonyl)-4-methoxy-phenyl]sulfonylamino]phenyl]acetamide Formula: C22H27N3O5S MolecularWeight: 445.53188

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCCCC3

Isomeric SMILES

CC(=O)NC1=CC(=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)N3CCCCCC3

InChI

InChI=1S/C22H27N3O5S/c1-16(26)23-17-8-7-9-18(14-17)24-31(28,29)19-10-11-21(30-2)20(15-19)22(27)25-12-5-3-4-6-13-25/h7-11,14-15,24H,3-6,12-13H2,1-2H3,(H,23,26)