4-(4-bromophenyl)sulfanyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-(4-bromophenyl)sulfanyl-3-nitro-benzenesulfonamide Openeye Name: 4-(4-bromophenyl)sulfanyl-3-nitro-benzenesulfonamide CAS Name: 4-[(4-bromophenyl)thio]-3-nitrobenzenesulfonamide IUPAC Name: 4-(4-bromophenyl)sulfanyl-3-nitrobenzenesulfonamide Traditional Name: 4-[(4-bromophenyl)thio]-3-nitro-benzenesulfonamide Formula: C12H9BrN2O4S2 MolecularWeight: 389.24486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC(=CC=C1SC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])Br

InChI

InChI=1S/C12H9BrN2O4S2/c13-8-1-3-9(4-2-8)20-12-6-5-10(21(14,18)19)7-11(12)15(16)17/h1-7H,(H2,14,18,19)