N-[(1-methylpyrrol-2-yl)methyl]-N-(3-morpholin-4-ylpropyl)octane-1-sulfonamide

Systemtic Name: N-[(1-methylpyrrol-2-yl)methyl]-N-(3-morpholin-4-ylpropyl)octane-1-sulfonamide Openeye Name: N-[(1-methylpyrrol-2-yl)methyl]-N-(3-morpholinopropyl)octane-1-sulfonamide CAS Name: N-[(1-methyl-2-pyrrolyl)methyl]-N-[3-(4-morpholinyl)propyl]-1-octanesulfonamide IUPAC Name: N-[(1-methylpyrrol-2-yl)methyl]-N-(3-morpholin-4-ylpropyl)octane-1-sulfonamide Traditional Name: N-[(1-methylpyrrol-2-yl)methyl]-N-(3-morpholinopropyl)octane-1-sulfonamide Formula: C21H39N3O3S MolecularWeight: 413.61766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCS(=O)(=O)N(CCCN1CCOCC1)CC2=CC=CN2C

Isomeric SMILES

CCCCCCCCS(=O)(=O)N(CCCN1CCOCC1)CC2=CC=CN2C

InChI

InChI=1S/C21H39N3O3S/c1-3-4-5-6-7-8-19-28(25,26)24(20-21-11-9-12-22(21)2)14-10-13-23-15-17-27-18-16-23/h9,11-12H,3-8,10,13-20H2,1-2H3