N-[(2-bromophenyl)methyl]-4-chloranyl-N-(2-oxidanylideneazepan-3-yl)benzenesulfonamide

Systemtic Name: N-[(2-bromophenyl)methyl]-4-chloranyl-N-(2-oxidanylideneazepan-3-yl)benzenesulfonamide Openeye Name: N-[(2-bromophenyl)methyl]-4-chloro-N-(2-oxoazepan-3-yl)benzenesulfonamide CAS Name: N-[(2-bromophenyl)methyl]-4-chloro-N-(2-oxo-3-azepanyl)benzenesulfonamide IUPAC Name: N-[(2-bromophenyl)methyl]-4-chloro-N-(2-oxoazepan-3-yl)benzenesulfonamide Traditional Name: N-(2-bromobenzyl)-4-chloro-N-(2-ketoazepan-3-yl)benzenesulfonamide Formula: C19H20BrClN2O3S MolecularWeight: 471.7957

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N(CC2=CC=CC=C2Br)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCNC(=O)C(C1)N(CC2=CC=CC=C2Br)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H20BrClN2O3S/c20-17-6-2-1-5-14(17)13-23(18-7-3-4-12-22-19(18)24)27(25,26)16-10-8-15(21)9-11-16/h1-2,5-6,8-11,18H,3-4,7,12-13H2,(H,22,24)