N-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]-2-methoxy-benzenesulfonamide

Systemtic Name: N-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]-2-methoxy-benzenesulfonamide Openeye Name: N-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]-2-methoxy-benzenesulfonamide CAS Name: N-[2-(1-azepanyl)-2-(1-methyl-2-pyrrolyl)ethyl]-2-methoxybenzenesulfonamide IUPAC Name: N-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]-2-methoxybenzenesulfonamide Traditional Name: N-[2-(azepan-1-yl)-2-(1-methylpyrrol-2-yl)ethyl]-2-methoxy-benzenesulfonamide Formula: C20H29N3O3S MolecularWeight: 391.52756

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC=C1C(CNS(=O)(=O)C2=CC=CC=C2OC)N3CCCCCC3

Isomeric SMILES

CN1C=CC=C1C(CNS(=O)(=O)C2=CC=CC=C2OC)N3CCCCCC3

InChI

InChI=1S/C20H29N3O3S/c1-22-13-9-10-17(22)18(23-14-7-3-4-8-15-23)16-21-27(24,25)20-12-6-5-11-19(20)26-2/h5-6,9-13,18,21H,3-4,7-8,14-16H2,1-2H3