4-[[4-[1-(4-fluorophenyl)-3,5-dimethyl-pyrazol-4-yl]carbonylpiperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[1-(4-fluorophenyl)-3,5-dimethyl-pyrazol-4-yl]carbonylpiperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[1-(4-fluorophenyl)-3,5-dimethyl-pyrazole-4-carbonyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[[1-(4-fluorophenyl)-3,5-dimethyl-4-pyrazolyl]-oxomethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[1-(4-fluorophenyl)-3,5-dimethylpyrazole-4-carbonyl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[1-(4-fluorophenyl)-3,5-dimethyl-pyrazole-4-carbonyl]piperazino]methyl]benzonitrile Formula: C24H24FN5O MolecularWeight: 417.478663

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)F)C)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)F)C)C(=O)N3CCN(CC3)CC4=CC=C(C=C4)C#N

InChI

InChI=1S/C24H24FN5O/c1-17-23(18(2)30(27-17)22-9-7-21(25)8-10-22)24(31)29-13-11-28(12-14-29)16-20-5-3-19(15-26)4-6-20/h3-10H,11-14,16H2,1-2H3