N-[3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]hexanamide

Systemtic Name: N-[3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]hexanamide Openeye Name: N-[3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]hexanamide CAS Name: N-[3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]phenyl]hexanamide IUPAC Name: N-[3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]phenyl]hexanamide Traditional Name: N-[3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]phenyl]hexanamide Formula: C21H23N5O MolecularWeight: 361.44022

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=CC=CC(=C1)NC2=NC=CC(=N2)C3=CN=CC=C3

Isomeric SMILES

CCCCCC(=O)NC1=CC=CC(=C1)NC2=NC=CC(=N2)C3=CN=CC=C3

InChI

InChI=1S/C21H23N5O/c1-2-3-4-10-20(27)24-17-8-5-9-18(14-17)25-21-23-13-11-19(26-21)16-7-6-12-22-15-16/h5-9,11-15H,2-4,10H2,1H3,(H,24,27)(H,23,25,26)