N-[3-[(4-butyl-1,4-diazepan-1-yl)carbonyl]phenyl]naphthalene-2-sulfonamide

Systemtic Name: N-[3-[(4-butyl-1,4-diazepan-1-yl)carbonyl]phenyl]naphthalene-2-sulfonamide Openeye Name: N-[3-(4-butyl-1,4-diazepane-1-carbonyl)phenyl]naphthalene-2-sulfonamide CAS Name: N-[3-[(4-butyl-1,4-diazepan-1-yl)-oxomethyl]phenyl]-2-naphthalenesulfonamide IUPAC Name: N-[3-(4-butyl-1,4-diazepane-1-carbonyl)phenyl]naphthalene-2-sulfonamide Traditional Name: N-[3-(4-butyl-1,4-diazepane-1-carbonyl)phenyl]naphthalene-2-sulfonamide Formula: C26H31N3O3S MolecularWeight: 465.60764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCCN(CC1)C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

CCCCN1CCCN(CC1)C(=O)C2=CC(=CC=C2)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C26H31N3O3S/c1-2-3-14-28-15-7-16-29(18-17-28)26(30)23-10-6-11-24(19-23)27-33(31,32)25-13-12-21-8-4-5-9-22(21)20-25/h4-6,8-13,19-20,27H,2-3,7,14-18H2,1H3