3-[3-(methylamino)-4-oxidanyl-phenyl]-N-(4-phenylbutyl)-2-(phenylsulfonylamino)propanamide

Systemtic Name: 3-[3-(methylamino)-4-oxidanyl-phenyl]-N-(4-phenylbutyl)-2-(phenylsulfonylamino)propanamide Openeye Name: 2-(benzenesulfonamido)-3-[4-hydroxy-3-(methylamino)phenyl]-N-(4-phenylbutyl)propanamide CAS Name: 2-(benzenesulfonamido)-3-[4-hydroxy-3-(methylamino)phenyl]-N-(4-phenylbutyl)propanamide IUPAC Name: 2-(benzenesulfonamido)-3-[4-hydroxy-3-(methylamino)phenyl]-N-(4-phenylbutyl)propanamide Traditional Name: 2-(benzenesulfonamido)-3-[4-hydroxy-3-(methylamino)phenyl]-N-(4-phenylbutyl)propionamide Formula: C26H31N3O4S MolecularWeight: 481.60704

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=CC(=C1)CC(C(=O)NCCCCC2=CC=CC=C2)NS(=O)(=O)C3=CC=CC=C3)O

Isomeric SMILES

CNC1=C(C=CC(=C1)CC(C(=O)NCCCCC2=CC=CC=C2)NS(=O)(=O)C3=CC=CC=C3)O

InChI

InChI=1S/C26H31N3O4S/c1-27-23-18-21(15-16-25(23)30)19-24(29-34(32,33)22-13-6-3-7-14-22)26(31)28-17-9-8-12-20-10-4-2-5-11-20/h2-7,10-11,13-16,18,24,27,29-30H,8-9,12,17,19H2,1H3,(H,28,31)