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

Systemtic Name: N6-[(4-fluoranyl-3-methyl-phenyl)methyl]-N4-(pyridin-3-ylmethyl)pyrimidine-4,6-dicarboxamide Openeye Name: N6-[(4-fluoro-3-methyl-phenyl)methyl]-N4-(3-pyridylmethyl)pyrimidine-4,6-dicarboxamide CAS Name: N6-[(4-fluoro-3-methylphenyl)methyl]-N4-(3-pyridinylmethyl)pyrimidine-4,6-dicarboxamide IUPAC Name: 6-N-[(4-fluoro-3-methylphenyl)methyl]-4-N-(pyridin-3-ylmethyl)pyrimidine-4,6-dicarboxamide Traditional Name: N'-(4-fluoro-3-methyl-benzyl)-N-(3-pyridylmethyl)pyrimidine-4,6-dicarboxamide Formula: C20H18FN5O2 MolecularWeight: 379.387623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CNC(=O)C2=CC(=NC=N2)C(=O)NCC3=CN=CC=C3)F

Isomeric SMILES

CC1=C(C=CC(=C1)CNC(=O)C2=CC(=NC=N2)C(=O)NCC3=CN=CC=C3)F

InChI

InChI=1S/C20H18FN5O2/c1-13-7-14(4-5-16(13)21)10-23-19(27)17-8-18(26-12-25-17)20(28)24-11-15-3-2-6-22-9-15/h2-9,12H,10-11H2,1H3,(H,23,27)(H,24,28)