4-[2-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-5-methyl-3-oxidanylidene-pyrazol-1-yl]benzenecarbonitrile

Systemtic Name: 4-[2-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-5-methyl-3-oxidanylidene-pyrazol-1-yl]benzenecarbonitrile Openeye Name: 4-[2-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-5-methyl-3-oxo-pyrazol-1-yl]benzonitrile CAS Name: 4-[2-[3-[4-(4-fluorophenyl)-1-piperazinyl]propyl]-5-methyl-3-oxo-1-pyrazolyl]benzonitrile IUPAC Name: 4-[2-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]-5-methyl-3-oxopyrazol-1-yl]benzonitrile Traditional Name: 4-[2-[3-[4-(4-fluorophenyl)piperazino]propyl]-3-keto-5-methyl-3-pyrazolin-1-yl]benzonitrile Formula: C24H26FN5O MolecularWeight: 419.494543

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N(N1C2=CC=C(C=C2)C#N)CCCN3CCN(CC3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC(=O)N(N1C2=CC=C(C=C2)C#N)CCCN3CCN(CC3)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H26FN5O/c1-19-17-24(31)29(30(19)23-7-3-20(18-26)4-8-23)12-2-11-27-13-15-28(16-14-27)22-9-5-21(25)6-10-22/h3-10,17H,2,11-16H2,1H3