N4,N6-bis[[4-fluoranyl-3-(trifluoromethyl)phenyl]methyl]pyrimidine-4,6-dicarboxamide

Systemtic Name: N4,N6-bis[[4-fluoranyl-3-(trifluoromethyl)phenyl]methyl]pyrimidine-4,6-dicarboxamide Openeye Name: N4,N6-bis[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]pyrimidine-4,6-dicarboxamide CAS Name: N4,N6-bis[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]pyrimidine-4,6-dicarboxamide IUPAC Name: 4-N,6-N-bis[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]pyrimidine-4,6-dicarboxamide Traditional Name: N,N'-bis[4-fluoro-3-(trifluoromethyl)benzyl]pyrimidine-4,6-dicarboxamide Formula: C22H14F8N4O2 MolecularWeight: 518.359386

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1CNC(=O)C2=CC(=NC=N2)C(=O)NCC3=CC(=C(C=C3)F)C(F)(F)F)C(F)(F)F)F

Isomeric SMILES

C1=CC(=C(C=C1CNC(=O)C2=CC(=NC=N2)C(=O)NCC3=CC(=C(C=C3)F)C(F)(F)F)C(F)(F)F)F

InChI

InChI=1S/C22H14F8N4O2/c23-15-3-1-11(5-13(15)21(25,26)27)8-31-19(35)17-7-18(34-10-33-17)20(36)32-9-12-2-4-16(24)14(6-12)22(28,29)30/h1-7,10H,8-9H2,(H,31,35)(H,32,36)