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

Systemtic Name: 2-[(4-ethylphenyl)methyl-methyl-amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[(4-ethylphenyl)methyl-methyl-amino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone CAS Name: 2-[(4-ethylphenyl)methyl-methylamino]-1-[4-(2-pyrimidinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(4-ethylphenyl)methyl-methylamino]-1-(4-pyrimidin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[(4-ethylbenzyl)-methyl-amino]-1-[4-(2-pyrimidyl)piperazino]ethanone Formula: C20H27N5O MolecularWeight: 353.46128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(C)CC(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CCC1=CC=C(C=C1)CN(C)CC(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C20H27N5O/c1-3-17-5-7-18(8-6-17)15-23(2)16-19(26)24-11-13-25(14-12-24)20-21-9-4-10-22-20/h4-10H,3,11-16H2,1-2H3