N-[[4-[[cycloheptylcarbamoyl-(naphthalen-2-ylsulfonylamino)amino]methyl]phenyl]methyl]ethanamide

Systemtic Name: N-[[4-[[cycloheptylcarbamoyl-(naphthalen-2-ylsulfonylamino)amino]methyl]phenyl]methyl]ethanamide Openeye Name: N-[[4-[[cycloheptylcarbamoyl-(2-naphthylsulfonylamino)amino]methyl]phenyl]methyl]acetamide CAS Name: N-[[4-[[[(cycloheptylamino)-oxomethyl]-(2-naphthalenylsulfonylamino)amino]methyl]phenyl]methyl]acetamide IUPAC Name: N-[[4-[[cycloheptylcarbamoyl-(naphthalen-2-ylsulfonylamino)amino]methyl]phenyl]methyl]acetamide Traditional Name: N-[4-[[cycloheptylcarbamoyl-(2-naphthylsulfonylamino)amino]methyl]benzyl]acetamide Formula: C28H34N4O4S MolecularWeight: 522.65896

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(C=C1)CN(C(=O)NC2CCCCCC2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CC(=O)NCC1=CC=C(C=C1)CN(C(=O)NC2CCCCCC2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C28H34N4O4S/c1-21(33)29-19-22-12-14-23(15-13-22)20-32(28(34)30-26-10-4-2-3-5-11-26)31-37(35,36)27-17-16-24-8-6-7-9-25(24)18-27/h6-9,12-18,26,31H,2-5,10-11,19-20H2,1H3,(H,29,33)(H,30,34)