4-chloranyl-N-(2-oxidanylideneazepan-3-yl)-N-[1-phenyl-2-(phenylsulfonyl)ethyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(2-oxidanylideneazepan-3-yl)-N-[1-phenyl-2-(phenylsulfonyl)ethyl]benzenesulfonamide Openeye Name: N-[2-(benzenesulfonyl)-1-phenyl-ethyl]-4-chloro-N-(2-oxoazepan-3-yl)benzenesulfonamide CAS Name: N-[2-(benzenesulfonyl)-1-phenylethyl]-4-chloro-N-(2-oxo-3-azepanyl)benzenesulfonamide IUPAC Name: N-[2-(benzenesulfonyl)-1-phenylethyl]-4-chloro-N-(2-oxoazepan-3-yl)benzenesulfonamide Traditional Name: N-(2-besyl-1-phenyl-ethyl)-4-chloro-N-(2-ketoazepan-3-yl)benzenesulfonamide Formula: C26H27ClN2O5S2 MolecularWeight: 547.08598

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N(C(CS(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCNC(=O)C(C1)N(C(CS(=O)(=O)C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C26H27ClN2O5S2/c27-21-14-16-23(17-15-21)36(33,34)29(24-13-7-8-18-28-26(24)30)25(20-9-3-1-4-10-20)19-35(31,32)22-11-5-2-6-12-22/h1-6,9-12,14-17,24-25H,7-8,13,18-19H2,(H,28,30)