2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholin-4-ylpropyl)-5-(naphthalen-2-ylsulfonylamino)benzamide

Systemtic Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholin-4-ylpropyl)-5-(naphthalen-2-ylsulfonylamino)benzamide Openeye Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholinopropyl)-5-(2-naphthylsulfonylamino)benzamide CAS Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-[3-(4-morpholinyl)propyl]-5-(2-naphthalenylsulfonylamino)benzamide IUPAC Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholin-4-ylpropyl)-5-(naphthalen-2-ylsulfonylamino)benzamide Traditional Name: 2-(3,4-dihydro-1H-isoquinolin-2-yl)-N-(3-morpholinopropyl)-5-(2-naphthylsulfonylamino)benzamide Formula: C33H36N4O4S MolecularWeight: 584.72834

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4)C(=O)NCCCN6CCOCC6

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C=C(C=C3)NS(=O)(=O)C4=CC5=CC=CC=C5C=C4)C(=O)NCCCN6CCOCC6

InChI

InChI=1S/C33H36N4O4S/c38-33(34-15-5-16-36-18-20-41-21-19-36)31-23-29(11-13-32(31)37-17-14-26-7-2-4-9-28(26)24-37)35-42(39,40)30-12-10-25-6-1-3-8-27(25)22-30/h1-4,6-13,22-23,35H,5,14-21,24H2,(H,34,38)