N2,N4-bis[4-chloranyl-3-(trifluoromethyl)phenyl]-5-fluoranyl-pyrimidine-2,4-diamine

Systemtic Name: N2,N4-bis[4-chloranyl-3-(trifluoromethyl)phenyl]-5-fluoranyl-pyrimidine-2,4-diamine Openeye Name: N2,N4-bis[4-chloro-3-(trifluoromethyl)phenyl]-5-fluoro-pyrimidine-2,4-diamine CAS Name: N2,N4-bis[4-chloro-3-(trifluoromethyl)phenyl]-5-fluoropyrimidine-2,4-diamine IUPAC Name: 2-N,4-N-bis[4-chloro-3-(trifluoromethyl)phenyl]-5-fluoropyrimidine-2,4-diamine Traditional Name: [2-[4-chloro-3-(trifluoromethyl)anilino]-5-fluoro-pyrimidin-4-yl]-[4-chloro-3-(trifluoromethyl)phenyl]amine Formula: C18H9Cl2F7N4 MolecularWeight: 485.185682

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC2=NC(=NC=C2F)NC3=CC(=C(C=C3)Cl)C(F)(F)F)C(F)(F)F)Cl

Isomeric SMILES

C1=CC(=C(C=C1NC2=NC(=NC=C2F)NC3=CC(=C(C=C3)Cl)C(F)(F)F)C(F)(F)F)Cl

InChI

InChI=1S/C18H9Cl2F7N4/c19-12-3-1-8(5-10(12)17(22,23)24)29-15-14(21)7-28-16(31-15)30-9-2-4-13(20)11(6-9)18(25,26)27/h1-7H,(H2,28,29,30,31)