2-[(6-chloranyl-2-imidazol-1-yl-pyrimidin-4-yl)amino]-N-[(4-methoxyphenyl)methyl]pentanediamide

Systemtic Name: 2-[(6-chloranyl-2-imidazol-1-yl-pyrimidin-4-yl)amino]-N-[(4-methoxyphenyl)methyl]pentanediamide Openeye Name: 2-[(6-chloro-2-imidazol-1-yl-pyrimidin-4-yl)amino]-N-[(4-methoxyphenyl)methyl]pentanediamide CAS Name: 2-[[6-chloro-2-(1-imidazolyl)-4-pyrimidinyl]amino]-N-[(4-methoxyphenyl)methyl]pentanediamide IUPAC Name: 2-[(6-chloro-2-imidazol-1-ylpyrimidin-4-yl)amino]-N-[(4-methoxyphenyl)methyl]pentanediamide Traditional Name: 2-[(6-chloro-2-imidazol-1-yl-pyrimidin-4-yl)amino]-N-p-anisyl-glutaramide Formula: C20H22ClN7O3 MolecularWeight: 443.88678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=O)C(CCC(=O)N)NC2=CC(=NC(=N2)N3C=CN=C3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=O)C(CCC(=O)N)NC2=CC(=NC(=N2)N3C=CN=C3)Cl

InChI

InChI=1S/C20H22ClN7O3/c1-31-14-4-2-13(3-5-14)11-24-19(30)15(6-7-17(22)29)25-18-10-16(21)26-20(27-18)28-9-8-23-12-28/h2-5,8-10,12,15H,6-7,11H2,1H3,(H2,22,29)(H,24,30)(H,25,26,27)