2-[[2,4-bis(fluoranyl)phenyl]methylsulfanyl]-N4-methyl-6-morpholin-4-yl-pyrimidine-4,5-diamine

Systemtic Name: 2-[[2,4-bis(fluoranyl)phenyl]methylsulfanyl]-N4-methyl-6-morpholin-4-yl-pyrimidine-4,5-diamine Openeye Name: 2-[(2,4-difluorophenyl)methylsulfanyl]-N4-methyl-6-morpholino-pyrimidine-4,5-diamine CAS Name: 2-[(2,4-difluorophenyl)methylthio]-N4-methyl-6-(4-morpholinyl)pyrimidine-4,5-diamine IUPAC Name: 2-[(2,4-difluorophenyl)methylsulfanyl]-4-N-methyl-6-morpholin-4-ylpyrimidine-4,5-diamine Traditional Name: [5-amino-2-[(2,4-difluorobenzyl)thio]-6-morpholino-pyrimidin-4-yl]-methyl-amine Formula: C16H19F2N5OS MolecularWeight: 367.416766

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC(=C1N)N2CCOCC2)SCC3=C(C=C(C=C3)F)F

Isomeric SMILES

CNC1=NC(=NC(=C1N)N2CCOCC2)SCC3=C(C=C(C=C3)F)F

InChI

InChI=1S/C16H19F2N5OS/c1-20-14-13(19)15(23-4-6-24-7-5-23)22-16(21-14)25-9-10-2-3-11(17)8-12(10)18/h2-3,8H,4-7,9,19H2,1H3,(H,20,21,22)