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

Systemtic Name: [3-(3-methylphenyl)-1-phenyl-pyrazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [3-(m-tolyl)-1-phenyl-pyrazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [3-(3-methylphenyl)-1-phenyl-4-pyrazolyl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: [3-(3-methylphenyl)-1-phenylpyrazol-4-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: [3-(m-tolyl)-1-phenyl-pyrazol-4-yl]-[4-(2-pyrimidyl)piperazino]methanone Formula: C25H24N6O MolecularWeight: 424.49766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN(C=C2C(=O)N3CCN(CC3)C4=NC=CC=N4)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN(C=C2C(=O)N3CCN(CC3)C4=NC=CC=N4)C5=CC=CC=C5

InChI

InChI=1S/C25H24N6O/c1-19-7-5-8-20(17-19)23-22(18-31(28-23)21-9-3-2-4-10-21)24(32)29-13-15-30(16-14-29)25-26-11-6-12-27-25/h2-12,17-18H,13-16H2,1H3