3-nitro-4-[(2-phenylsulfanylphenyl)amino]benzenesulfonamide

Systemtic Name: 3-nitro-4-[(2-phenylsulfanylphenyl)amino]benzenesulfonamide Openeye Name: 3-nitro-4-(2-phenylsulfanylanilino)benzenesulfonamide CAS Name: 3-nitro-4-[2-(phenylthio)anilino]benzenesulfonamide IUPAC Name: 3-nitro-4-(2-phenylsulfanylanilino)benzenesulfonamide Traditional Name: 3-nitro-4-[2-(phenylthio)anilino]benzenesulfonamide Formula: C18H15N3O4S2 MolecularWeight: 401.4594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=CC=CC=C2NC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)SC2=CC=CC=C2NC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O4S2/c19-27(24,25)14-10-11-15(17(12-14)21(22)23)20-16-8-4-5-9-18(16)26-13-6-2-1-3-7-13/h1-12,20H,(H2,19,24,25)