4-chloranyl-N-(2-oxidanylideneazepan-3-yl)-N-[phenylsulfonyl(1H-pyrrol-2-yl)methyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(2-oxidanylideneazepan-3-yl)-N-[phenylsulfonyl(1H-pyrrol-2-yl)methyl]benzenesulfonamide Openeye Name: N-[benzenesulfonyl(1H-pyrrol-2-yl)methyl]-4-chloro-N-(2-oxoazepan-3-yl)benzenesulfonamide CAS Name: N-[benzenesulfonyl(1H-pyrrol-2-yl)methyl]-4-chloro-N-(2-oxo-3-azepanyl)benzenesulfonamide IUPAC Name: N-[benzenesulfonyl(1H-pyrrol-2-yl)methyl]-4-chloro-N-(2-oxoazepan-3-yl)benzenesulfonamide Traditional Name: N-[besyl(1H-pyrrol-2-yl)methyl]-4-chloro-N-(2-ketoazepan-3-yl)benzenesulfonamide Formula: C23H24ClN3O5S2 MolecularWeight: 522.03676

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N(C(C2=CC=CN2)S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCNC(=O)C(C1)N(C(C2=CC=CN2)S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H24ClN3O5S2/c24-17-11-13-19(14-12-17)34(31,32)27(21-10-4-5-15-26-22(21)28)23(20-9-6-16-25-20)33(29,30)18-7-2-1-3-8-18/h1-3,6-9,11-14,16,21,23,25H,4-5,10,15H2,(H,26,28)