3-[[5-fluoranyl-4-[(2-methylquinolin-6-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide

Systemtic Name: 3-[[5-fluoranyl-4-[(2-methylquinolin-6-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide Openeye Name: 3-[[5-fluoro-4-[(2-methyl-6-quinolyl)amino]pyrimidin-2-yl]amino]benzenesulfonamide CAS Name: 3-[[5-fluoro-4-[(2-methyl-6-quinolinyl)amino]-2-pyrimidinyl]amino]benzenesulfonamide IUPAC Name: 3-[[5-fluoro-4-[(2-methylquinolin-6-yl)amino]pyrimidin-2-yl]amino]benzenesulfonamide Traditional Name: 3-[[5-fluoro-4-[(2-methyl-6-quinolyl)amino]pyrimidin-2-yl]amino]benzenesulfonamide Formula: C20H17FN6O2S MolecularWeight: 424.451383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C=C(C=C2)NC3=NC(=NC=C3F)NC4=CC(=CC=C4)S(=O)(=O)N

Isomeric SMILES

CC1=NC2=C(C=C1)C=C(C=C2)NC3=NC(=NC=C3F)NC4=CC(=CC=C4)S(=O)(=O)N

InChI

InChI=1S/C20H17FN6O2S/c1-12-5-6-13-9-15(7-8-18(13)24-12)25-19-17(21)11-23-20(27-19)26-14-3-2-4-16(10-14)30(22,28)29/h2-11H,1H3,(H2,22,28,29)(H2,23,25,26,27)