[4-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]piperazin-1-yl]-(4-phenylphenyl)methanone

Systemtic Name: [4-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]piperazin-1-yl]-(4-phenylphenyl)methanone Openeye Name: [4-[6-(4-methyl-1-piperidyl)pyrimidin-4-yl]piperazin-1-yl]-(4-phenylphenyl)methanone CAS Name: [4-[6-(4-methyl-1-piperidinyl)-4-pyrimidinyl]-1-piperazinyl]-(4-phenylphenyl)methanone IUPAC Name: [4-[6-(4-methylpiperidin-1-yl)pyrimidin-4-yl]piperazin-1-yl]-(4-phenylphenyl)methanone Traditional Name: [4-[6-(4-methylpiperidino)pyrimidin-4-yl]piperazino]-(4-phenylphenyl)methanone Formula: C27H31N5O MolecularWeight: 441.56794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

CC1CCN(CC1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H31N5O/c1-21-11-13-30(14-12-21)25-19-26(29-20-28-25)31-15-17-32(18-16-31)27(33)24-9-7-23(8-10-24)22-5-3-2-4-6-22/h2-10,19-21H,11-18H2,1H3