2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-6-methyl-pyrimidin-4-amine

Systemtic Name: 2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-6-methyl-pyrimidin-4-amine Openeye Name: 2-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-6-methyl-pyrimidin-4-amine CAS Name: 2-[(3-fluoro-4-methoxyphenyl)methylthio]-6-methyl-4-pyrimidinamine IUPAC Name: 2-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-6-methylpyrimidin-4-amine Traditional Name: [2-[(3-fluoro-4-methoxy-benzyl)thio]-6-methyl-pyrimidin-4-yl]amine Formula: C13H14FN3OS MolecularWeight: 279.333163

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC2=CC(=C(C=C2)OC)F)N

Isomeric SMILES

CC1=CC(=NC(=N1)SCC2=CC(=C(C=C2)OC)F)N

InChI

InChI=1S/C13H14FN3OS/c1-8-5-12(15)17-13(16-8)19-7-9-3-4-11(18-2)10(14)6-9/h3-6H,7H2,1-2H3,(H2,15,16,17)