N-(1,3-benzothiazol-2-yl)-2-nitro-benzenesulfonamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-nitro-benzenesulfonamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-nitro-benzenesulfonamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-nitrobenzenesulfonamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-nitrobenzenesulfonamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-nitro-benzenesulfonamide Formula: C13H9N3O4S2 MolecularWeight: 335.35826

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C13H9N3O4S2/c17-16(18)10-6-2-4-8-12(10)22(19,20)15-13-14-9-5-1-3-7-11(9)21-13/h1-8H,(H,14,15)