N-[6-(dimethylamino)-9-[(4-fluorophenyl)methyl]purin-8-yl]pyridine-2-carboxamide

Systemtic Name: N-[6-(dimethylamino)-9-[(4-fluorophenyl)methyl]purin-8-yl]pyridine-2-carboxamide Openeye Name: N-[6-(dimethylamino)-9-[(4-fluorophenyl)methyl]purin-8-yl]pyridine-2-carboxamide CAS Name: N-[6-(dimethylamino)-9-[(4-fluorophenyl)methyl]-8-purinyl]-2-pyridinecarboxamide IUPAC Name: N-[6-(dimethylamino)-9-[(4-fluorophenyl)methyl]purin-8-yl]pyridine-2-carboxamide Traditional Name: N-[6-(dimethylamino)-9-(4-fluorobenzyl)purin-8-yl]picolinamide Formula: C20H18FN7O MolecularWeight: 391.401623

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=NC2=C1N=C(N2CC3=CC=C(C=C3)F)NC(=O)C4=CC=CC=N4

Isomeric SMILES

CN(C)C1=NC=NC2=C1N=C(N2CC3=CC=C(C=C3)F)NC(=O)C4=CC=CC=N4

InChI

InChI=1S/C20H18FN7O/c1-27(2)17-16-18(24-12-23-17)28(11-13-6-8-14(21)9-7-13)20(25-16)26-19(29)15-5-3-4-10-22-15/h3-10,12H,11H2,1-2H3,(H,25,26,29)