4-[[5-bromanyl-4-[(6-methylpyridin-2-yl)amino]pyrimidin-2-yl]amino]-N-(3-imidazol-1-ylpropyl)benzamide

Systemtic Name: 4-[[5-bromanyl-4-[(6-methylpyridin-2-yl)amino]pyrimidin-2-yl]amino]-N-(3-imidazol-1-ylpropyl)benzamide Openeye Name: 4-[[5-bromo-4-[(6-methyl-2-pyridyl)amino]pyrimidin-2-yl]amino]-N-(3-imidazol-1-ylpropyl)benzamide CAS Name: 4-[[5-bromo-4-[(6-methyl-2-pyridinyl)amino]-2-pyrimidinyl]amino]-N-[3-(1-imidazolyl)propyl]benzamide IUPAC Name: 4-[[5-bromo-4-[(6-methylpyridin-2-yl)amino]pyrimidin-2-yl]amino]-N-(3-imidazol-1-ylpropyl)benzamide Traditional Name: 4-[[5-bromo-4-[(6-methyl-2-pyridyl)amino]pyrimidin-2-yl]amino]-N-(3-imidazol-1-ylpropyl)benzamide Formula: C23H23BrN8O MolecularWeight: 507.38572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)NC2=NC(=NC=C2Br)NC3=CC=C(C=C3)C(=O)NCCCN4C=CN=C4

Isomeric SMILES

CC1=NC(=CC=C1)NC2=NC(=NC=C2Br)NC3=CC=C(C=C3)C(=O)NCCCN4C=CN=C4

InChI

InChI=1S/C23H23BrN8O/c1-16-4-2-5-20(28-16)30-21-19(24)14-27-23(31-21)29-18-8-6-17(7-9-18)22(33)26-10-3-12-32-13-11-25-15-32/h2,4-9,11,13-15H,3,10,12H2,1H3,(H,26,33)(H2,27,28,29,30,31)