N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-3-(dimethylsulfamoyl)benzamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-3-(dimethylsulfamoyl)benzamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-3-(dimethylsulfamoyl)benzamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-3-(dimethylsulfamoyl)benzamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-3-(dimethylsulfamoyl)benzamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-3-(dimethylsulfamoyl)benzamide Formula: C22H29N3O6S2 MolecularWeight: 495.61216

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O6S2/c1-24(2)32(27,28)18-10-8-9-17(15-18)22(26)23-20-16-19(11-12-21(20)31-3)33(29,30)25-13-6-4-5-7-14-25/h8-12,15-16H,4-7,13-14H2,1-3H3,(H,23,26)