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

Systemtic Name: 4-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoranyl-pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: 4-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoro-pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 4-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoro-2-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: 4-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoropyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: 4-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoro-pyrimidin-2-yl]amino]benzenesulfonamide Formula: C19H18FN7O2S MolecularWeight: 427.455323

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC2=C1C=NN2)C3=NC(=NC=C3F)NC4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

CCN(C1=CC=CC2=C1C=NN2)C3=NC(=NC=C3F)NC4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C19H18FN7O2S/c1-2-27(17-5-3-4-16-14(17)10-23-26-16)18-15(20)11-22-19(25-18)24-12-6-8-13(9-7-12)30(21,28)29/h3-11H,2H2,1H3,(H,23,26)(H2,21,28,29)(H,22,24,25)