4-[2-(4-bromophenyl)sulfanylethylamino]-N-methyl-3-nitro-benzenesulfonamide

Systemtic Name: 4-[2-(4-bromophenyl)sulfanylethylamino]-N-methyl-3-nitro-benzenesulfonamide Openeye Name: 4-[2-(4-bromophenyl)sulfanylethylamino]-N-methyl-3-nitro-benzenesulfonamide CAS Name: 4-[2-[(4-bromophenyl)thio]ethylamino]-N-methyl-3-nitrobenzenesulfonamide IUPAC Name: 4-[2-(4-bromophenyl)sulfanylethylamino]-N-methyl-3-nitrobenzenesulfonamide Traditional Name: 4-[2-[(4-bromophenyl)thio]ethylamino]-N-methyl-3-nitro-benzenesulfonamide Formula: C15H16BrN3O4S2 MolecularWeight: 446.33924

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Descriptors Computed from Structure

Canonical SMILES:

CNS(=O)(=O)C1=CC(=C(C=C1)NCCSC2=CC=C(C=C2)Br)[N+](=O)[O-]

Isomeric SMILES

CNS(=O)(=O)C1=CC(=C(C=C1)NCCSC2=CC=C(C=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C15H16BrN3O4S2/c1-17-25(22,23)13-6-7-14(15(10-13)19(20)21)18-8-9-24-12-4-2-11(16)3-5-12/h2-7,10,17-18H,8-9H2,1H3