[2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylamino]-3H-benzimidazol-5-yl] 4-fluoranylbenzenesulfonate

Systemtic Name: [2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylamino]-3H-benzimidazol-5-yl] 4-fluoranylbenzenesulfonate Openeye Name: [2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylamino]-3H-benzimidazol-5-yl] 4-fluorobenzenesulfonate CAS Name: 4-fluorobenzenesulfonic acid [2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylamino]-3H-benzimidazol-5-yl] ester IUPAC Name: [2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylamino]-3H-benzimidazol-5-yl] 4-fluorobenzenesulfonate Traditional Name: 4-fluorobenzenesulfonic acid [2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylamino]-3H-benzimidazol-5-yl] ester Formula: C22H16FN5O4S MolecularWeight: 465.456943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NOC(=N2)CNC3=NC4=C(N3)C=C(C=C4)OS(=O)(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1=CC=C(C=C1)C2=NOC(=N2)CNC3=NC4=C(N3)C=C(C=C4)OS(=O)(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C22H16FN5O4S/c23-15-6-9-17(10-7-15)33(29,30)32-16-8-11-18-19(12-16)26-22(25-18)24-13-20-27-21(28-31-20)14-4-2-1-3-5-14/h1-12H,13H2,(H2,24,25,26)