6-(2-fluoranyl-5-methylsulfonyl-phenyl)-5-quinolin-3-yl-pyrimidine-2,4-diamine

Systemtic Name: 6-(2-fluoranyl-5-methylsulfonyl-phenyl)-5-quinolin-3-yl-pyrimidine-2,4-diamine Openeye Name: 6-(2-fluoro-5-methylsulfonyl-phenyl)-5-(3-quinolyl)pyrimidine-2,4-diamine CAS Name: 6-(2-fluoro-5-methylsulfonylphenyl)-5-(3-quinolinyl)pyrimidine-2,4-diamine IUPAC Name: 6-(2-fluoro-5-methylsulfonylphenyl)-5-quinolin-3-ylpyrimidine-2,4-diamine Traditional Name: [2-amino-6-(2-fluoro-5-mesyl-phenyl)-5-(3-quinolyl)pyrimidin-4-yl]amine Formula: C20H16FN5O2S MolecularWeight: 409.436743

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)F)C2=C(C(=NC(=N2)N)N)C3=CC4=CC=CC=C4N=C3

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)F)C2=C(C(=NC(=N2)N)N)C3=CC4=CC=CC=C4N=C3

InChI

InChI=1S/C20H16FN5O2S/c1-29(27,28)13-6-7-15(21)14(9-13)18-17(19(22)26-20(23)25-18)12-8-11-4-2-3-5-16(11)24-10-12/h2-10H,1H3,(H4,22,23,25,26)