4-phenyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]piperazine-1-carboxamide

Systemtic Name: 4-phenyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]piperazine-1-carboxamide Openeye Name: 4-phenyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]piperazine-1-carboxamide CAS Name: 4-phenyl-N-[3-[4-(2-pyrimidinyl)-1-piperazinyl]propyl]-1-piperazinecarboxamide IUPAC Name: 4-phenyl-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)propyl]piperazine-1-carboxamide Traditional Name: 4-phenyl-N-[3-[4-(2-pyrimidyl)piperazino]propyl]piperazine-1-carboxamide Formula: C22H31N7O MolecularWeight: 409.52784

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=O)N2CCN(CC2)C3=CC=CC=C3)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1CCCNC(=O)N2CCN(CC2)C3=CC=CC=C3)C4=NC=CC=N4

InChI

InChI=1S/C22H31N7O/c30-22(29-18-16-27(17-19-29)20-6-2-1-3-7-20)25-10-5-11-26-12-14-28(15-13-26)21-23-8-4-9-24-21/h1-4,6-9H,5,10-19H2,(H,25,30)