2-methyl-1-[4-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]carbonylpiperazin-1-yl]propan-1-one

Systemtic Name: 2-methyl-1-[4-[3-(4-methylphenyl)-1-phenyl-pyrazol-4-yl]carbonylpiperazin-1-yl]propan-1-one Openeye Name: 2-methyl-1-[4-[1-phenyl-3-(p-tolyl)pyrazole-4-carbonyl]piperazin-1-yl]propan-1-one CAS Name: 2-methyl-1-[4-[[3-(4-methylphenyl)-1-phenyl-4-pyrazolyl]-oxomethyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-methyl-1-[4-[3-(4-methylphenyl)-1-phenylpyrazole-4-carbonyl]piperazin-1-yl]propan-1-one Traditional Name: 2-methyl-1-[4-[1-phenyl-3-(p-tolyl)pyrazole-4-carbonyl]piperazino]propan-1-one Formula: C25H28N4O2 MolecularWeight: 416.51542

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H28N4O2/c1-18(2)24(30)27-13-15-28(16-14-27)25(31)22-17-29(21-7-5-4-6-8-21)26-23(22)20-11-9-19(3)10-12-20/h4-12,17-18H,13-16H2,1-3H3