N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(dimethylsulfamoyl)-4,5-dimethyl-benzamide

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(dimethylsulfamoyl)-4,5-dimethyl-benzamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(dimethylsulfamoyl)-4,5-dimethyl-benzamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-3-(dimethylsulfamoyl)-4,5-dimethylbenzamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(dimethylsulfamoyl)-4,5-dimethylbenzamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-3-(dimethylsulfamoyl)-4,5-dimethyl-benzamide Formula: C23H31N3O5S2 MolecularWeight: 493.63934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)S(=O)(=O)N(C)C)C

Isomeric SMILES

CC1=C(C(=CC(=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3)S(=O)(=O)N(C)C)C

InChI

InChI=1S/C23H31N3O5S2/c1-17-15-19(16-22(18(17)2)33(30,31)25(3)4)23(27)24-20-9-11-21(12-10-20)32(28,29)26-13-7-5-6-8-14-26/h9-12,15-16H,5-8,13-14H2,1-4H3,(H,24,27)