2-[4-[5-ethyl-1-(4-fluorophenyl)pyrazol-4-yl]carbonylpiperazin-1-yl]-6-fluoranyl-benzenecarbonitrile

Systemtic Name: 2-[4-[5-ethyl-1-(4-fluorophenyl)pyrazol-4-yl]carbonylpiperazin-1-yl]-6-fluoranyl-benzenecarbonitrile Openeye Name: 2-[4-[5-ethyl-1-(4-fluorophenyl)pyrazole-4-carbonyl]piperazin-1-yl]-6-fluoro-benzonitrile CAS Name: 2-[4-[[5-ethyl-1-(4-fluorophenyl)-4-pyrazolyl]-oxomethyl]-1-piperazinyl]-6-fluorobenzonitrile IUPAC Name: 2-[4-[5-ethyl-1-(4-fluorophenyl)pyrazole-4-carbonyl]piperazin-1-yl]-6-fluorobenzonitrile Traditional Name: 2-[4-[5-ethyl-1-(4-fluorophenyl)pyrazole-4-carbonyl]piperazino]-6-fluoro-benzonitrile Formula: C23H21F2N5O MolecularWeight: 421.442546

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=NN1C2=CC=C(C=C2)F)C(=O)N3CCN(CC3)C4=C(C(=CC=C4)F)C#N

Isomeric SMILES

CCC1=C(C=NN1C2=CC=C(C=C2)F)C(=O)N3CCN(CC3)C4=C(C(=CC=C4)F)C#N

InChI

InChI=1S/C23H21F2N5O/c1-2-21-19(15-27-30(21)17-8-6-16(24)7-9-17)23(31)29-12-10-28(11-13-29)22-5-3-4-20(25)18(22)14-26/h3-9,15H,2,10-13H2,1H3