3-[2-[6-(methylamino)-2-pyridin-2-yl-pyrimidin-4-yl]pyridin-3-yl]-N-(oxan-4-yl)benzamide

Systemtic Name: 3-[2-[6-(methylamino)-2-pyridin-2-yl-pyrimidin-4-yl]pyridin-3-yl]-N-(oxan-4-yl)benzamide Openeye Name: 3-[2-[6-(methylamino)-2-(2-pyridyl)pyrimidin-4-yl]-3-pyridyl]-N-tetrahydropyran-4-yl-benzamide CAS Name: 3-[2-[6-(methylamino)-2-(2-pyridinyl)-4-pyrimidinyl]-3-pyridinyl]-N-(4-oxanyl)benzamide IUPAC Name: 3-[2-[6-(methylamino)-2-pyridin-2-ylpyrimidin-4-yl]pyridin-3-yl]-N-(oxan-4-yl)benzamide Traditional Name: 3-[2-[6-(methylamino)-2-(2-pyridyl)pyrimidin-4-yl]-3-pyridyl]-N-tetrahydropyran-4-yl-benzamide Formula: C27H26N6O2 MolecularWeight: 466.53434

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC(=C1)C2=C(C=CC=N2)C3=CC(=CC=C3)C(=O)NC4CCOCC4)C5=CC=CC=N5

Isomeric SMILES

CNC1=NC(=NC(=C1)C2=C(C=CC=N2)C3=CC(=CC=C3)C(=O)NC4CCOCC4)C5=CC=CC=N5

InChI

InChI=1S/C27H26N6O2/c1-28-24-17-23(32-26(33-24)22-9-2-3-12-29-22)25-21(8-5-13-30-25)18-6-4-7-19(16-18)27(34)31-20-10-14-35-15-11-20/h2-9,12-13,16-17,20H,10-11,14-15H2,1H3,(H,31,34)(H,28,32,33)