5-(azepan-1-ylcarbonyl)-N-propyl-2-pyrrolidin-1-yl-benzenesulfonamide

Systemtic Name: 5-(azepan-1-ylcarbonyl)-N-propyl-2-pyrrolidin-1-yl-benzenesulfonamide Openeye Name: 5-(azepane-1-carbonyl)-N-propyl-2-pyrrolidin-1-yl-benzenesulfonamide CAS Name: 5-[1-azepanyl(oxo)methyl]-N-propyl-2-(1-pyrrolidinyl)benzenesulfonamide IUPAC Name: 5-(azepane-1-carbonyl)-N-propyl-2-pyrrolidin-1-ylbenzenesulfonamide Traditional Name: 5-(azepane-1-carbonyl)-N-propyl-2-pyrrolidino-benzenesulfonamide Formula: C20H31N3O3S MolecularWeight: 393.54344

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Descriptors Computed from Structure

Canonical SMILES:

CCCNS(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCCCCC2)N3CCCC3

Isomeric SMILES

CCCNS(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CCCCCC2)N3CCCC3

InChI

InChI=1S/C20H31N3O3S/c1-2-11-21-27(25,26)19-16-17(9-10-18(19)22-12-7-8-13-22)20(24)23-14-5-3-4-6-15-23/h9-10,16,21H,2-8,11-15H2,1H3