2-chloranyl-N-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethyl]-5-fluoranyl-pyrimidin-4-amine

Systemtic Name: 2-chloranyl-N-[2-[(2-chloranyl-6-fluoranyl-phenyl)methylsulfanyl]ethyl]-5-fluoranyl-pyrimidin-4-amine Openeye Name: 2-chloro-N-[2-[(2-chloro-6-fluoro-phenyl)methylsulfanyl]ethyl]-5-fluoro-pyrimidin-4-amine CAS Name: 2-chloro-N-[2-[(2-chloro-6-fluorophenyl)methylthio]ethyl]-5-fluoro-4-pyrimidinamine IUPAC Name: 2-chloro-N-[2-[(2-chloro-6-fluorophenyl)methylsulfanyl]ethyl]-5-fluoropyrimidin-4-amine Traditional Name: 2-[(2-chloro-6-fluoro-benzyl)thio]ethyl-(2-chloro-5-fluoro-pyrimidin-4-yl)amine Formula: C13H11Cl2F2N3S MolecularWeight: 350.214346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CSCCNC2=NC(=NC=C2F)Cl)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CSCCNC2=NC(=NC=C2F)Cl)F

InChI

InChI=1S/C13H11Cl2F2N3S/c14-9-2-1-3-10(16)8(9)7-21-5-4-18-12-11(17)6-19-13(15)20-12/h1-3,6H,4-5,7H2,(H,18,19,20)