N4-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-N6-(2,3-dihydro-1-benzofuran-5-ylmethyl)pyrimidine-4,6-dicarboxamide

Systemtic Name: N4-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-N6-(2,3-dihydro-1-benzofuran-5-ylmethyl)pyrimidine-4,6-dicarboxamide Openeye Name: N4-[(3-chloro-4-fluoro-phenyl)methyl]-N6-(2,3-dihydrobenzofuran-5-ylmethyl)pyrimidine-4,6-dicarboxamide CAS Name: N4-[(3-chloro-4-fluorophenyl)methyl]-N6-(2,3-dihydrobenzofuran-5-ylmethyl)pyrimidine-4,6-dicarboxamide IUPAC Name: 4-N-[(3-chloro-4-fluorophenyl)methyl]-6-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)pyrimidine-4,6-dicarboxamide Traditional Name: N-(3-chloro-4-fluoro-benzyl)-N'-(coumaran-5-ylmethyl)pyrimidine-4,6-dicarboxamide Formula: C22H18ClFN4O3 MolecularWeight: 440.854723

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C1C=C(C=C2)CNC(=O)C3=CC(=NC=N3)C(=O)NCC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1COC2=C1C=C(C=C2)CNC(=O)C3=CC(=NC=N3)C(=O)NCC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C22H18ClFN4O3/c23-16-8-14(1-3-17(16)24)11-26-22(30)19-9-18(27-12-28-19)21(29)25-10-13-2-4-20-15(7-13)5-6-31-20/h1-4,7-9,12H,5-6,10-11H2,(H,25,29)(H,26,30)