2-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-1-(4-cyclopropylcarbonylpiperazin-1-yl)ethanone

Systemtic Name: 2-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-1-(4-cyclopropylcarbonylpiperazin-1-yl)ethanone Openeye Name: 2-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-1-[4-(cyclopropanecarbonyl)piperazin-1-yl]ethanone CAS Name: 2-[3-(4-chlorophenyl)-1-phenyl-4-pyrazolyl]-1-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]ethanone IUPAC Name: 2-[3-(4-chlorophenyl)-1-phenylpyrazol-4-yl]-1-[4-(cyclopropanecarbonyl)piperazin-1-yl]ethanone Traditional Name: 2-[3-(4-chlorophenyl)-1-phenyl-pyrazol-4-yl]-1-[4-(cyclopropanecarbonyl)piperazino]ethanone Formula: C25H25ClN4O2 MolecularWeight: 448.9446

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCN(CC2)C(=O)CC3=CN(N=C3C4=CC=C(C=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

C1CC1C(=O)N2CCN(CC2)C(=O)CC3=CN(N=C3C4=CC=C(C=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C25H25ClN4O2/c26-21-10-8-18(9-11-21)24-20(17-30(27-24)22-4-2-1-3-5-22)16-23(31)28-12-14-29(15-13-28)25(32)19-6-7-19/h1-5,8-11,17,19H,6-7,12-16H2