4-fluoranyl-N-[3-[(4-pyridin-2-ylpyrimidin-2-yl)amino]phenyl]benzenesulfonamide

Systemtic Name: 4-fluoranyl-N-[3-[(4-pyridin-2-ylpyrimidin-2-yl)amino]phenyl]benzenesulfonamide Openeye Name: 4-fluoro-N-[3-[[4-(2-pyridyl)pyrimidin-2-yl]amino]phenyl]benzenesulfonamide CAS Name: 4-fluoro-N-[3-[[4-(2-pyridinyl)-2-pyrimidinyl]amino]phenyl]benzenesulfonamide IUPAC Name: 4-fluoro-N-[3-[(4-pyridin-2-ylpyrimidin-2-yl)amino]phenyl]benzenesulfonamide Traditional Name: 4-fluoro-N-[3-[[4-(2-pyridyl)pyrimidin-2-yl]amino]phenyl]benzenesulfonamide Formula: C21H16FN5O2S MolecularWeight: 421.447443

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=NC(=NC=C2)NC3=CC(=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=NC(=C1)C2=NC(=NC=C2)NC3=CC(=CC=C3)NS(=O)(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H16FN5O2S/c22-15-7-9-18(10-8-15)30(28,29)27-17-5-3-4-16(14-17)25-21-24-13-11-20(26-21)19-6-1-2-12-23-19/h1-14,27H,(H,24,25,26)