4-(azepan-1-ylsulfonyl)-N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]benzamide

Systemtic Name: 4-(azepan-1-ylsulfonyl)-N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]benzamide Openeye Name: 4-(azepan-1-ylsulfonyl)-N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]benzamide CAS Name: 4-(1-azepanylsulfonyl)-N-[5-(dimethylsulfamoyl)-2-methylphenyl]benzamide IUPAC Name: 4-(azepan-1-ylsulfonyl)-N-[5-(dimethylsulfamoyl)-2-methylphenyl]benzamide Traditional Name: 4-(azepan-1-ylsulfonyl)-N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]benzamide Formula: C22H29N3O5S2 MolecularWeight: 479.61276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C22H29N3O5S2/c1-17-8-11-20(31(27,28)24(2)3)16-21(17)23-22(26)18-9-12-19(13-10-18)32(29,30)25-14-6-4-5-7-15-25/h8-13,16H,4-7,14-15H2,1-3H3,(H,23,26)