6-(2,3-dihydroindol-1-yl)-N4-(3-fluoranyl-4-pyridin-4-ylsulfanyl-phenyl)pyrimidine-2,4-diamine

Systemtic Name: 6-(2,3-dihydroindol-1-yl)-N4-(3-fluoranyl-4-pyridin-4-ylsulfanyl-phenyl)pyrimidine-2,4-diamine Openeye Name: N4-[3-fluoro-4-(4-pyridylsulfanyl)phenyl]-6-indolin-1-yl-pyrimidine-2,4-diamine CAS Name: 6-(2,3-dihydroindol-1-yl)-N4-[3-fluoro-4-(pyridin-4-ylthio)phenyl]pyrimidine-2,4-diamine IUPAC Name: 6-(2,3-dihydroindol-1-yl)-4-N-(3-fluoro-4-pyridin-4-ylsulfanylphenyl)pyrimidine-2,4-diamine Traditional Name: (2-amino-6-indolin-1-yl-pyrimidin-4-yl)-[3-fluoro-4-(4-pyridylthio)phenyl]amine Formula: C23H19FN6S MolecularWeight: 430.500563

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)C3=CC(=NC(=N3)N)NC4=CC(=C(C=C4)SC5=CC=NC=C5)F

Isomeric SMILES

C1CN(C2=CC=CC=C21)C3=CC(=NC(=N3)N)NC4=CC(=C(C=C4)SC5=CC=NC=C5)F

InChI

InChI=1S/C23H19FN6S/c24-18-13-16(5-6-20(18)31-17-7-10-26-11-8-17)27-21-14-22(29-23(25)28-21)30-12-9-15-3-1-2-4-19(15)30/h1-8,10-11,13-14H,9,12H2,(H3,25,27,28,29)