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

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-2-methoxy-5-sulfamoyl-benzamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-2-methoxy-5-sulfamoyl-benzamide CAS Name: N-[4-(1-azepanyl)phenyl]-2-methoxy-5-sulfamoylbenzamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-2-methoxy-5-sulfamoylbenzamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-2-methoxy-5-sulfamoyl-benzamide Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)NC2=CC=C(C=C2)N3CCCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N)C(=O)NC2=CC=C(C=C2)N3CCCCCC3

InChI

InChI=1S/C20H25N3O4S/c1-27-19-11-10-17(28(21,25)26)14-18(19)20(24)22-15-6-8-16(9-7-15)23-12-4-2-3-5-13-23/h6-11,14H,2-5,12-13H2,1H3,(H,22,24)(H2,21,25,26)