N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanamide

Systemtic Name: N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethanamide Openeye Name: 2-(4-benzyl-1,4-diazepan-1-yl)-N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]acetamide CAS Name: N-[5-(dimethylsulfamoyl)-2-methylphenyl]-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]acetamide IUPAC Name: 2-(4-benzyl-1,4-diazepan-1-yl)-N-[5-(dimethylsulfamoyl)-2-methylphenyl]acetamide Traditional Name: 2-(4-benzyl-1,4-diazepan-1-yl)-N-[5-(dimethylsulfamoyl)-2-methyl-phenyl]acetamide Formula: C23H32N4O3S MolecularWeight: 444.59018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=O)CN2CCCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)NC(=O)CN2CCCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C23H32N4O3S/c1-19-10-11-21(31(29,30)25(2)3)16-22(19)24-23(28)18-27-13-7-12-26(14-15-27)17-20-8-5-4-6-9-20/h4-6,8-11,16H,7,12-15,17-18H2,1-3H3,(H,24,28)