4-[5-[(4-chlorophenyl)methyl]-2,6-dimethyl-pyrimidin-4-yl]-N-(3-methylphenyl)piperazine-1-carboxamide

Systemtic Name: 4-[5-[(4-chlorophenyl)methyl]-2,6-dimethyl-pyrimidin-4-yl]-N-(3-methylphenyl)piperazine-1-carboxamide Openeye Name: 4-[5-[(4-chlorophenyl)methyl]-2,6-dimethyl-pyrimidin-4-yl]-N-(m-tolyl)piperazine-1-carboxamide CAS Name: 4-[5-[(4-chlorophenyl)methyl]-2,6-dimethyl-4-pyrimidinyl]-N-(3-methylphenyl)-1-piperazinecarboxamide IUPAC Name: 4-[5-[(4-chlorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl]-N-(3-methylphenyl)piperazine-1-carboxamide Traditional Name: 4-[5-(4-chlorobenzyl)-2,6-dimethyl-pyrimidin-4-yl]-N-(m-tolyl)piperazine-1-carboxamide Formula: C25H28ClN5O MolecularWeight: 449.97572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N2CCN(CC2)C3=NC(=NC(=C3CC4=CC=C(C=C4)Cl)C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N2CCN(CC2)C3=NC(=NC(=C3CC4=CC=C(C=C4)Cl)C)C

InChI

InChI=1S/C25H28ClN5O/c1-17-5-4-6-22(15-17)29-25(32)31-13-11-30(12-14-31)24-23(18(2)27-19(3)28-24)16-20-7-9-21(26)10-8-20/h4-10,15H,11-14,16H2,1-3H3,(H,29,32)