1-[4-[5-[(2-chlorophenyl)methyl]-2,6-dimethyl-pyrimidin-4-yl]piperazin-1-yl]-3-piperidin-1-yl-propan-2-ol

Systemtic Name: 1-[4-[5-[(2-chlorophenyl)methyl]-2,6-dimethyl-pyrimidin-4-yl]piperazin-1-yl]-3-piperidin-1-yl-propan-2-ol Openeye Name: 1-[4-[5-[(2-chlorophenyl)methyl]-2,6-dimethyl-pyrimidin-4-yl]piperazin-1-yl]-3-(1-piperidyl)propan-2-ol CAS Name: 1-[4-[5-[(2-chlorophenyl)methyl]-2,6-dimethyl-4-pyrimidinyl]-1-piperazinyl]-3-(1-piperidinyl)-2-propanol IUPAC Name: 1-[4-[5-[(2-chlorophenyl)methyl]-2,6-dimethylpyrimidin-4-yl]piperazin-1-yl]-3-piperidin-1-ylpropan-2-ol Traditional Name: 1-[4-[5-(2-chlorobenzyl)-2,6-dimethyl-pyrimidin-4-yl]piperazino]-3-piperidino-propan-2-ol Formula: C25H36ClN5O MolecularWeight: 458.03924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)N2CCN(CC2)CC(CN3CCCCC3)O)CC4=CC=CC=C4Cl

Isomeric SMILES

CC1=C(C(=NC(=N1)C)N2CCN(CC2)CC(CN3CCCCC3)O)CC4=CC=CC=C4Cl

InChI

InChI=1S/C25H36ClN5O/c1-19-23(16-21-8-4-5-9-24(21)26)25(28-20(2)27-19)31-14-12-30(13-15-31)18-22(32)17-29-10-6-3-7-11-29/h4-5,8-9,22,32H,3,6-7,10-18H2,1-2H3