N-[4-(azepan-1-ylsulfonyl)phenyl]-4-methoxy-3-sulfamoyl-benzamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-methoxy-3-sulfamoyl-benzamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-methoxy-3-sulfamoyl-benzamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-4-methoxy-3-sulfamoylbenzamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-methoxy-3-sulfamoylbenzamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-methoxy-3-sulfamoyl-benzamide Formula: C20H25N3O6S2 MolecularWeight: 467.559

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O6S2/c1-29-18-11-6-15(14-19(18)30(21,25)26)20(24)22-16-7-9-17(10-8-16)31(27,28)23-12-4-2-3-5-13-23/h6-11,14H,2-5,12-13H2,1H3,(H,22,24)(H2,21,25,26)