2-[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone

Systemtic Name: 2-[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone Openeye Name: 2-[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]-1-[4-(2-pyridyl)piperazin-1-yl]ethanone CAS Name: 2-[(1,3-diphenyl-4-pyrazolyl)methyl-methylamino]-1-[4-(2-pyridinyl)-1-piperazinyl]ethanone IUPAC Name: 2-[(1,3-diphenylpyrazol-4-yl)methyl-methylamino]-1-(4-pyridin-2-ylpiperazin-1-yl)ethanone Traditional Name: 2-[(1,3-diphenylpyrazol-4-yl)methyl-methyl-amino]-1-[4-(2-pyridyl)piperazino]ethanone Formula: C28H30N6O MolecularWeight: 466.5774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)CC(=O)N4CCN(CC4)C5=CC=CC=N5

Isomeric SMILES

CN(CC1=CN(N=C1C2=CC=CC=C2)C3=CC=CC=C3)CC(=O)N4CCN(CC4)C5=CC=CC=N5

InChI

InChI=1S/C28H30N6O/c1-31(22-27(35)33-18-16-32(17-19-33)26-14-8-9-15-29-26)20-24-21-34(25-12-6-3-7-13-25)30-28(24)23-10-4-2-5-11-23/h2-15,21H,16-20,22H2,1H3