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

Systemtic Name: N-[3-[(2-butyl-1,4-diazepan-1-yl)carbonyl]phenyl]-N-(trifluoromethyl)benzenesulfonamide Openeye Name: N-[3-(2-butyl-1,4-diazepane-1-carbonyl)phenyl]-N-(trifluoromethyl)benzenesulfonamide CAS Name: N-[3-[(2-butyl-1,4-diazepan-1-yl)-oxomethyl]phenyl]-N-(trifluoromethyl)benzenesulfonamide IUPAC Name: N-[3-(2-butyl-1,4-diazepane-1-carbonyl)phenyl]-N-(trifluoromethyl)benzenesulfonamide Traditional Name: N-[3-(2-butyl-1,4-diazepane-1-carbonyl)phenyl]-N-(trifluoromethyl)benzenesulfonamide Formula: C23H28F3N3O3S MolecularWeight: 483.54693

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1CNCCCN1C(=O)C2=CC(=CC=C2)N(C(F)(F)F)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCC1CNCCCN1C(=O)C2=CC(=CC=C2)N(C(F)(F)F)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H28F3N3O3S/c1-2-3-10-20-17-27-14-8-15-28(20)22(30)18-9-7-11-19(16-18)29(23(24,25)26)33(31,32)21-12-5-4-6-13-21/h4-7,9,11-13,16,20,27H,2-3,8,10,14-15,17H2,1H3