N-(3,3-dimethyl-2H-1-benzofuran-6-yl)-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide

Systemtic Name: N-(3,3-dimethyl-2H-1-benzofuran-6-yl)-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide Openeye Name: N-(3,3-dimethyl-2H-benzofuran-6-yl)-2-(4-pyridylmethylamino)pyridine-3-carboxamide CAS Name: N-(3,3-dimethyl-2H-benzofuran-6-yl)-2-(pyridin-4-ylmethylamino)-3-pyridinecarboxamide IUPAC Name: N-(3,3-dimethyl-2H-1-benzofuran-6-yl)-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide Traditional Name: N-(3,3-dimethylcoumaran-6-yl)-2-(4-pyridylmethylamino)nicotinamide Formula: C22H22N4O2 MolecularWeight: 374.43568

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC2=C1C=CC(=C2)NC(=O)C3=C(N=CC=C3)NCC4=CC=NC=C4)C

Isomeric SMILES

CC1(COC2=C1C=CC(=C2)NC(=O)C3=C(N=CC=C3)NCC4=CC=NC=C4)C

InChI

InChI=1S/C22H22N4O2/c1-22(2)14-28-19-12-16(5-6-18(19)22)26-21(27)17-4-3-9-24-20(17)25-13-15-7-10-23-11-8-15/h3-12H,13-14H2,1-2H3,(H,24,25)(H,26,27)