3-[[5-fluoranyl-4-[1H-indazol-4-yl(3-oxidanylpropyl)amino]pyrimidin-2-yl]amino]benzenesulfonamide

Systemtic Name: 3-[[5-fluoranyl-4-[1H-indazol-4-yl(3-oxidanylpropyl)amino]pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: 3-[[5-fluoro-4-[3-hydroxypropyl(1H-indazol-4-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 3-[[5-fluoro-4-[3-hydroxypropyl(1H-indazol-4-yl)amino]-2-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: 3-[[5-fluoro-4-[3-hydroxypropyl(1H-indazol-4-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: 3-[[5-fluoro-4-[3-hydroxypropyl(1H-indazol-4-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide Formula: C20H20FN7O3S MolecularWeight: 457.481303

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)N)NC2=NC=C(C(=N2)N(CCCO)C3=CC=CC4=C3C=NN4)F

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)N)NC2=NC=C(C(=N2)N(CCCO)C3=CC=CC4=C3C=NN4)F

InChI

InChI=1S/C20H20FN7O3S/c21-16-12-23-20(25-13-4-1-5-14(10-13)32(22,30)31)26-19(16)28(8-3-9-29)18-7-2-6-17-15(18)11-24-27-17/h1-2,4-7,10-12,29H,3,8-9H2,(H,24,27)(H2,22,30,31)(H,23,25,26)