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

Systemtic Name: 6-chloranyl-N4-(3-fluoranyl-4-pyridin-4-ylsulfanyl-phenyl)pyrimidine-2,4-diamine Openeye Name: 6-chloro-N4-[3-fluoro-4-(4-pyridylsulfanyl)phenyl]pyrimidine-2,4-diamine CAS Name: 6-chloro-N4-[3-fluoro-4-(pyridin-4-ylthio)phenyl]pyrimidine-2,4-diamine IUPAC Name: 6-chloro-4-N-(3-fluoro-4-pyridin-4-ylsulfanylphenyl)pyrimidine-2,4-diamine Traditional Name: (2-amino-6-chloro-pyrimidin-4-yl)-[3-fluoro-4-(4-pyridylthio)phenyl]amine Formula: C15H11ClFN5S MolecularWeight: 347.797743

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=CC(=NC(=N2)N)Cl)F)SC3=CC=NC=C3

Isomeric SMILES

C1=CC(=C(C=C1NC2=CC(=NC(=N2)N)Cl)F)SC3=CC=NC=C3

InChI

InChI=1S/C15H11ClFN5S/c16-13-8-14(22-15(18)21-13)20-9-1-2-12(11(17)7-9)23-10-3-5-19-6-4-10/h1-8H,(H3,18,20,21,22)