N-[4-[[2-(azepan-1-yl)-5-chloranyl-phenyl]sulfamoyl]-2-methoxy-phenyl]ethanamide

Systemtic Name: N-[4-[[2-(azepan-1-yl)-5-chloranyl-phenyl]sulfamoyl]-2-methoxy-phenyl]ethanamide Openeye Name: N-[4-[[2-(azepan-1-yl)-5-chloro-phenyl]sulfamoyl]-2-methoxy-phenyl]acetamide CAS Name: N-[4-[[2-(1-azepanyl)-5-chlorophenyl]sulfamoyl]-2-methoxyphenyl]acetamide IUPAC Name: N-[4-[[2-(azepan-1-yl)-5-chlorophenyl]sulfamoyl]-2-methoxyphenyl]acetamide Traditional Name: N-[4-[[2-(azepan-1-yl)-5-chloro-phenyl]sulfamoyl]-2-methoxy-phenyl]acetamide Formula: C21H26ClN3O4S MolecularWeight: 451.96684

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)Cl)N3CCCCCC3)OC

Isomeric SMILES

CC(=O)NC1=C(C=C(C=C1)S(=O)(=O)NC2=C(C=CC(=C2)Cl)N3CCCCCC3)OC

InChI

InChI=1S/C21H26ClN3O4S/c1-15(26)23-18-9-8-17(14-21(18)29-2)30(27,28)24-19-13-16(22)7-10-20(19)25-11-5-3-4-6-12-25/h7-10,13-14,24H,3-6,11-12H2,1-2H3,(H,23,26)