4-[(4-bromophenyl)methylsulfanyl]-3-nitro-N-phenyl-benzenesulfonamide

Systemtic Name: 4-[(4-bromophenyl)methylsulfanyl]-3-nitro-N-phenyl-benzenesulfonamide Openeye Name: 4-[(4-bromophenyl)methylsulfanyl]-3-nitro-N-phenyl-benzenesulfonamide CAS Name: 4-[(4-bromophenyl)methylthio]-3-nitro-N-phenylbenzenesulfonamide IUPAC Name: 4-[(4-bromophenyl)methylsulfanyl]-3-nitro-N-phenylbenzenesulfonamide Traditional Name: 4-[(4-bromobenzyl)thio]-3-nitro-N-phenyl-benzenesulfonamide Formula: C19H15BrN2O4S2 MolecularWeight: 479.3674

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)SCC3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)SCC3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C19H15BrN2O4S2/c20-15-8-6-14(7-9-15)13-27-19-11-10-17(12-18(19)22(23)24)28(25,26)21-16-4-2-1-3-5-16/h1-12,21H,13H2