4-[[4-[3-(4-fluorophenyl)-2,1-benzoxazol-5-yl]pyrimidin-2-yl]amino]benzenesulfonamide

Systemtic Name: 4-[[4-[3-(4-fluorophenyl)-2,1-benzoxazol-5-yl]pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: 4-[[4-[3-(4-fluorophenyl)-2,1-benzoxazol-5-yl]pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 4-[[4-[3-(4-fluorophenyl)-2,1-benzoxazol-5-yl]-2-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: 4-[[4-[3-(4-fluorophenyl)-2,1-benzoxazol-5-yl]pyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: 4-[[4-[3-(4-fluorophenyl)anthranil-5-yl]pyrimidin-2-yl]amino]benzenesulfonamide Formula: C23H16FN5O3S MolecularWeight: 461.468243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C3C=C(C=CC3=NO2)C4=NC(=NC=C4)NC5=CC=C(C=C5)S(=O)(=O)N)F

Isomeric SMILES

C1=CC(=CC=C1C2=C3C=C(C=CC3=NO2)C4=NC(=NC=C4)NC5=CC=C(C=C5)S(=O)(=O)N)F

InChI

InChI=1S/C23H16FN5O3S/c24-16-4-1-14(2-5-16)22-19-13-15(3-10-21(19)29-32-22)20-11-12-26-23(28-20)27-17-6-8-18(9-7-17)33(25,30)31/h1-13H,(H2,25,30,31)(H,26,27,28)