N-(2-oxidanyl-3-phenoxy-propyl)-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide

Systemtic Name: N-(2-oxidanyl-3-phenoxy-propyl)-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide Openeye Name: N-(2-hydroxy-3-phenoxy-propyl)-2-(4-pyridylmethylamino)pyridine-3-carboxamide CAS Name: N-(2-hydroxy-3-phenoxypropyl)-2-(pyridin-4-ylmethylamino)-3-pyridinecarboxamide IUPAC Name: N-(2-hydroxy-3-phenoxypropyl)-2-(pyridin-4-ylmethylamino)pyridine-3-carboxamide Traditional Name: N-(2-hydroxy-3-phenoxy-propyl)-2-(4-pyridylmethylamino)nicotinamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCC(CNC(=O)C2=C(N=CC=C2)NCC3=CC=NC=C3)O

Isomeric SMILES

C1=CC=C(C=C1)OCC(CNC(=O)C2=C(N=CC=C2)NCC3=CC=NC=C3)O

InChI

InChI=1S/C21H22N4O3/c26-17(15-28-18-5-2-1-3-6-18)14-25-21(27)19-7-4-10-23-20(19)24-13-16-8-11-22-12-9-16/h1-12,17,26H,13-15H2,(H,23,24)(H,25,27)