[3-(2-methylphenyl)-1-phenyl-pyrazol-4-yl]-(4-pyridin-4-ylpiperazin-1-yl)methanone

Systemtic Name: [3-(2-methylphenyl)-1-phenyl-pyrazol-4-yl]-(4-pyridin-4-ylpiperazin-1-yl)methanone Openeye Name: [3-(o-tolyl)-1-phenyl-pyrazol-4-yl]-[4-(4-pyridyl)piperazin-1-yl]methanone CAS Name: [3-(2-methylphenyl)-1-phenyl-4-pyrazolyl]-(4-pyridin-4-yl-1-piperazinyl)methanone IUPAC Name: [3-(2-methylphenyl)-1-phenylpyrazol-4-yl]-(4-pyridin-4-ylpiperazin-1-yl)methanone Traditional Name: [3-(o-tolyl)-1-phenyl-pyrazol-4-yl]-[4-(4-pyridyl)piperazino]methanone Formula: C26H25N5O MolecularWeight: 423.5096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN(C=C2C(=O)N3CCN(CC3)C4=CC=NC=C4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC=C1C2=NN(C=C2C(=O)N3CCN(CC3)C4=CC=NC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H25N5O/c1-20-7-5-6-10-23(20)25-24(19-31(28-25)22-8-3-2-4-9-22)26(32)30-17-15-29(16-18-30)21-11-13-27-14-12-21/h2-14,19H,15-18H2,1H3