2-[(2-chlorophenyl)methyl-methyl-amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[(2-chlorophenyl)methyl-methyl-amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[(2-chlorophenyl)methyl-methyl-amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[(2-chlorophenyl)methyl-methylamino]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(2-chlorophenyl)methyl-methylamino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[(2-chlorobenzyl)-methyl-amino]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C18H22ClN5O MolecularWeight: 359.85318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1Cl)CC(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CN(CC1=CC=CC=C1Cl)CC(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C18H22ClN5O/c1-22(13-15-5-2-3-6-16(15)19)14-17(25)23-9-11-24(12-10-23)18-20-7-4-8-21-18/h2-8H,9-14H2,1H3