N4-(3-fluoranyl-4-pyridin-4-ylsulfanyl-phenyl)-6-quinolin-6-yl-pyrimidine-2,4-diamine

Systemtic Name: N4-(3-fluoranyl-4-pyridin-4-ylsulfanyl-phenyl)-6-quinolin-6-yl-pyrimidine-2,4-diamine Openeye Name: N4-[3-fluoro-4-(4-pyridylsulfanyl)phenyl]-6-(6-quinolyl)pyrimidine-2,4-diamine CAS Name: N4-[3-fluoro-4-(pyridin-4-ylthio)phenyl]-6-(6-quinolinyl)pyrimidine-2,4-diamine IUPAC Name: 4-N-(3-fluoro-4-pyridin-4-ylsulfanylphenyl)-6-quinolin-6-ylpyrimidine-2,4-diamine Traditional Name: [2-amino-6-(6-quinolyl)pyrimidin-4-yl]-[3-fluoro-4-(4-pyridylthio)phenyl]amine Formula: C24H17FN6S MolecularWeight: 440.495383

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)C3=CC(=NC(=N3)N)NC4=CC(=C(C=C4)SC5=CC=NC=C5)F)N=C1

Isomeric SMILES

C1=CC2=C(C=CC(=C2)C3=CC(=NC(=N3)N)NC4=CC(=C(C=C4)SC5=CC=NC=C5)F)N=C1

InChI

InChI=1S/C24H17FN6S/c25-19-13-17(4-6-22(19)32-18-7-10-27-11-8-18)29-23-14-21(30-24(26)31-23)16-3-5-20-15(12-16)2-1-9-28-20/h1-14H,(H3,26,29,30,31)