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

Systemtic Name: N4,N6-bis[(3-chloranyl-4-fluoranyl-phenyl)methyl]pyrimidine-4,6-dicarboxamide Openeye Name: N4,N6-bis[(3-chloro-4-fluoro-phenyl)methyl]pyrimidine-4,6-dicarboxamide CAS Name: N4,N6-bis[(3-chloro-4-fluorophenyl)methyl]pyrimidine-4,6-dicarboxamide IUPAC Name: 4-N,6-N-bis[(3-chloro-4-fluorophenyl)methyl]pyrimidine-4,6-dicarboxamide Traditional Name: N,N'-bis(3-chloro-4-fluoro-benzyl)pyrimidine-4,6-dicarboxamide Formula: C20H14Cl2F2N4O2 MolecularWeight: 451.253566

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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)Cl)Cl)F

Isomeric SMILES

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

InChI

InChI=1S/C20H14Cl2F2N4O2/c21-13-5-11(1-3-15(13)23)8-25-19(29)17-7-18(28-10-27-17)20(30)26-9-12-2-4-16(24)14(22)6-12/h1-7,10H,8-9H2,(H,25,29)(H,26,30)