N-[2-(4-chlorophenyl)sulfanylphenyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-3-nitro-benzenesulfonamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-3-nitro-benzenesulfonamide CAS Name: N-[2-[(4-chlorophenyl)thio]phenyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-3-nitrobenzenesulfonamide Traditional Name: N-[2-[(4-chlorophenyl)thio]phenyl]-3-nitro-benzenesulfonamide Formula: C18H13ClN2O4S2 MolecularWeight: 420.88982

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])SC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C(=C1)NS(=O)(=O)C2=CC=CC(=C2)[N+](=O)[O-])SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H13ClN2O4S2/c19-13-8-10-15(11-9-13)26-18-7-2-1-6-17(18)20-27(24,25)16-5-3-4-14(12-16)21(22)23/h1-12,20H