[4-[5-[(2-chlorophenyl)methyl]-2,6-dimethyl-pyrimidin-4-yl]piperazin-1-yl]-cyclohexyl-methanone

Systemtic Name: [4-[5-[(2-chlorophenyl)methyl]-2,6-dimethyl-pyrimidin-4-yl]piperazin-1-yl]-cyclohexyl-methanone Openeye Name: [4-[5-[(2-chlorophenyl)methyl]-2,6-dimethyl-pyrimidin-4-yl]piperazin-1-yl]-cyclohexyl-methanone CAS Name: [4-[5-[(2-chlorophenyl)methyl]-2,6-dimethyl-4-pyrimidinyl]-1-piperazinyl]-cyclohexylmethanone IUPAC Name: [4-[5-[(2-chlorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl]piperazin-1-yl]-cyclohexylmethanone Traditional Name: [4-[5-(2-chlorobenzyl)-2,6-dimethyl-pyrimidin-4-yl]piperazino]-cyclohexyl-methanone Formula: C24H31ClN4O MolecularWeight: 426.98214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)C3CCCCC3)CC4=CC=CC=C4Cl

Isomeric SMILES

CC1=C(C(=NC(=N1)C)N2CCN(CC2)C(=O)C3CCCCC3)CC4=CC=CC=C4Cl

InChI

InChI=1S/C24H31ClN4O/c1-17-21(16-20-10-6-7-11-22(20)25)23(27-18(2)26-17)28-12-14-29(15-13-28)24(30)19-8-4-3-5-9-19/h6-7,10-11,19H,3-5,8-9,12-16H2,1-2H3