N-[4-(dimethylsulfamoyl)phenyl]-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-[4-(dimethylsulfamoyl)phenyl]-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanamide Openeye Name: 2-(4-benzyl-1,4-diazepan-1-yl)-N-[4-(dimethylsulfamoyl)phenyl]acetamide CAS Name: N-[4-(dimethylsulfamoyl)phenyl]-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]acetamide IUPAC Name: 2-(4-benzyl-1,4-diazepan-1-yl)-N-[4-(dimethylsulfamoyl)phenyl]acetamide Traditional Name: 2-(4-benzyl-1,4-diazepan-1-yl)-N-[4-(dimethylsulfamoyl)phenyl]acetamide Formula: C22H30N4O3S MolecularWeight: 430.5636

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)CN2CCCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)CN2CCCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H30N4O3S/c1-24(2)30(28,29)21-11-9-20(10-12-21)23-22(27)18-26-14-6-13-25(15-16-26)17-19-7-4-3-5-8-19/h3-5,7-12H,6,13-18H2,1-2H3,(H,23,27)