2-[4-(3-methylphenyl)carbonyl-1,4-diazepan-1-yl]-N-[2-(4-sulfamoylphenyl)ethyl]ethanamide

Systemtic Name: 2-[4-(3-methylphenyl)carbonyl-1,4-diazepan-1-yl]-N-[2-(4-sulfamoylphenyl)ethyl]ethanamide Openeye Name: 2-[4-(3-methylbenzoyl)-1,4-diazepan-1-yl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide CAS Name: 2-[4-[(3-methylphenyl)-oxomethyl]-1,4-diazepan-1-yl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide IUPAC Name: 2-[4-(3-methylbenzoyl)-1,4-diazepan-1-yl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide Traditional Name: 2-(4-m-toluoyl-1,4-diazepan-1-yl)-N-[2-(4-sulfamoylphenyl)ethyl]acetamide Formula: C23H30N4O4S MolecularWeight: 458.5737

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)N2CCCN(CC2)CC(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)N2CCCN(CC2)CC(=O)NCCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C23H30N4O4S/c1-18-4-2-5-20(16-18)23(29)27-13-3-12-26(14-15-27)17-22(28)25-11-10-19-6-8-21(9-7-19)32(24,30)31/h2,4-9,16H,3,10-15,17H2,1H3,(H,25,28)(H2,24,30,31)