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

Systemtic Name: N-[(4-bromanylthiophen-2-yl)methyl]-4-chloranyl-N-(2-oxidanylideneazepan-3-yl)benzenesulfonamide Openeye Name: N-[(4-bromo-2-thienyl)methyl]-4-chloro-N-(2-oxoazepan-3-yl)benzenesulfonamide CAS Name: N-[(4-bromo-2-thiophenyl)methyl]-4-chloro-N-(2-oxo-3-azepanyl)benzenesulfonamide IUPAC Name: N-[(4-bromothiophen-2-yl)methyl]-4-chloro-N-(2-oxoazepan-3-yl)benzenesulfonamide Traditional Name: N-[(4-bromo-2-thienyl)methyl]-4-chloro-N-(2-ketoazepan-3-yl)benzenesulfonamide Formula: C17H18BrClN2O3S2 MolecularWeight: 477.82342

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)N(CC2=CC(=CS2)Br)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCNC(=O)C(C1)N(CC2=CC(=CS2)Br)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H18BrClN2O3S2/c18-12-9-14(25-11-12)10-21(16-3-1-2-8-20-17(16)22)26(23,24)15-6-4-13(19)5-7-15/h4-7,9,11,16H,1-3,8,10H2,(H,20,22)