(4-propylphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (4-propylphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: (4-propylphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: (4-propylphenyl)-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (4-propylphenyl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (4-propylphenyl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C18H22N4O MolecularWeight: 310.39348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC=CC=N3

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC=CC=N3

InChI

InChI=1S/C18H22N4O/c1-2-4-15-5-7-16(8-6-15)17(23)21-11-13-22(14-12-21)18-19-9-3-10-20-18/h3,5-10H,2,4,11-14H2,1H3