N-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]pyridine-4-carboxamide

Systemtic Name: N-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]pyridine-4-carboxamide Openeye Name: N-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]pyridine-4-carboxamide CAS Name: N-[1-[2-(1-phenylethylamino)-4-pyrimidinyl]-5-benzimidazolyl]-4-pyridinecarboxamide IUPAC Name: N-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]pyridine-4-carboxamide Traditional Name: N-[1-[2-(1-phenylethylamino)pyrimidin-4-yl]benzimidazol-5-yl]isonicotinamide Formula: C25H21N7O MolecularWeight: 435.48054

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)NC(=O)C5=CC=NC=C5

Isomeric SMILES

CC(C1=CC=CC=C1)NC2=NC=CC(=N2)N3C=NC4=C3C=CC(=C4)NC(=O)C5=CC=NC=C5

InChI

InChI=1S/C25H21N7O/c1-17(18-5-3-2-4-6-18)29-25-27-14-11-23(31-25)32-16-28-21-15-20(7-8-22(21)32)30-24(33)19-9-12-26-13-10-19/h2-17H,1H3,(H,30,33)(H,27,29,31)