4-chloranyl-N-[1-(1H-indol-3-yl)ethyl]-N-(2-oxidanylideneazepan-3-yl)benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[1-(1H-indol-3-yl)ethyl]-N-(2-oxidanylideneazepan-3-yl)benzenesulfonamide Openeye Name: 4-chloro-N-[1-(1H-indol-3-yl)ethyl]-N-(2-oxoazepan-3-yl)benzenesulfonamide CAS Name: 4-chloro-N-[1-(1H-indol-3-yl)ethyl]-N-(2-oxo-3-azepanyl)benzenesulfonamide IUPAC Name: 4-chloro-N-[1-(1H-indol-3-yl)ethyl]-N-(2-oxoazepan-3-yl)benzenesulfonamide Traditional Name: 4-chloro-N-[1-(1H-indol-3-yl)ethyl]-N-(2-ketoazepan-3-yl)benzenesulfonamide Formula: C22H24ClN3O3S MolecularWeight: 445.96226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CNC2=CC=CC=C21)N(C3CCCCNC3=O)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC(C1=CNC2=CC=CC=C21)N(C3CCCCNC3=O)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H24ClN3O3S/c1-15(19-14-25-20-7-3-2-6-18(19)20)26(21-8-4-5-13-24-22(21)27)30(28,29)17-11-9-16(23)10-12-17/h2-3,6-7,9-12,14-15,21,25H,4-5,8,13H2,1H3,(H,24,27)