4-[(7-oxidanylidenepyrrolo[2,3-g][1,3]benzothiazol-8-yl)methylamino]-N-pyridin-2-yl-benzenesulfonamide

Systemtic Name: 4-[(7-oxidanylidenepyrrolo[2,3-g][1,3]benzothiazol-8-yl)methylamino]-N-pyridin-2-yl-benzenesulfonamide Openeye Name: 4-[(7-oxopyrrolo[2,3-g][1,3]benzothiazol-8-yl)methylamino]-N-(2-pyridyl)benzenesulfonamide CAS Name: 4-[(7-oxo-8-pyrrolo[2,3-g][1,3]benzothiazolyl)methylamino]-N-(2-pyridinyl)benzenesulfonamide IUPAC Name: 4-[(7-oxopyrrolo[2,3-g][1,3]benzothiazol-8-yl)methylamino]-N-pyridin-2-ylbenzenesulfonamide Traditional Name: 4-[(7-ketopyrrolo[2,3-g][1,3]benzothiazol-8-yl)methylamino]-N-(2-pyridyl)benzenesulfonamide Formula: C21H15N5O3S2 MolecularWeight: 449.5055

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NCC3=C4C(=NC3=O)C=CC5=C4SC=N5

Isomeric SMILES

C1=CC=NC(=C1)NS(=O)(=O)C2=CC=C(C=C2)NCC3=C4C(=NC3=O)C=CC5=C4SC=N5

InChI

InChI=1S/C21H15N5O3S2/c27-21-15(19-16(25-21)8-9-17-20(19)30-12-24-17)11-23-13-4-6-14(7-5-13)31(28,29)26-18-3-1-2-10-22-18/h1-10,12,23H,11H2,(H,22,26)