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

Systemtic Name: 3-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoranyl-pyrimidin-2-yl]amino]-4-methyl-benzenesulfonamide Openeye Name: 3-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoro-pyrimidin-2-yl]amino]-4-methyl-benzenesulfonamide CAS Name: 3-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoro-2-pyrimidinyl]amino]-4-methylbenzenesulfonamide IUPAC Name: 3-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoropyrimidin-2-yl]amino]-4-methylbenzenesulfonamide Traditional Name: 3-[[4-[ethyl(1H-indazol-4-yl)amino]-5-fluoro-pyrimidin-2-yl]amino]-4-methyl-benzenesulfonamide Formula: C20H20FN7O2S MolecularWeight: 441.481903

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20FN7O2S/c1-3-28(18-6-4-5-16-14(18)10-24-27-16)19-15(21)11-23-20(26-19)25-17-9-13(31(22,29)30)8-7-12(17)2/h4-11H,3H2,1-2H3,(H,24,27)(H2,22,29,30)(H,23,25,26)