2-[1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperidin-2-yl]-N-[(4-nitrophenyl)methyl]ethanamide

Systemtic Name: 2-[1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)piperidin-2-yl]-N-[(4-nitrophenyl)methyl]ethanamide Openeye Name: 2-[1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-2-piperidyl]-N-[(4-nitrophenyl)methyl]acetamide CAS Name: 2-[1-[2-(1-imidazolyl)-6-methyl-4-pyrimidinyl]-2-piperidinyl]-N-[(4-nitrophenyl)methyl]acetamide IUPAC Name: 2-[1-(2-imidazol-1-yl-6-methylpyrimidin-4-yl)piperidin-2-yl]-N-[(4-nitrophenyl)methyl]acetamide Traditional Name: 2-[1-(2-imidazol-1-yl-6-methyl-pyrimidin-4-yl)-2-piperidyl]-N-(4-nitrobenzyl)acetamide Formula: C22H25N7O3 MolecularWeight: 435.479

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C=CN=C2)N3CCCCC3CC(=O)NCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NC(=N1)N2C=CN=C2)N3CCCCC3CC(=O)NCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H25N7O3/c1-16-12-20(26-22(25-16)27-11-9-23-15-27)28-10-3-2-4-19(28)13-21(30)24-14-17-5-7-18(8-6-17)29(31)32/h5-9,11-12,15,19H,2-4,10,13-14H2,1H3,(H,24,30)