1-(4-fluorophenyl)-4-(4-pyridazin-3-ylpiperazin-1-yl)cyclohex-3-ene-1-carbonitrile

Systemtic Name: 1-(4-fluorophenyl)-4-(4-pyridazin-3-ylpiperazin-1-yl)cyclohex-3-ene-1-carbonitrile Openeye Name: 1-(4-fluorophenyl)-4-(4-pyridazin-3-ylpiperazin-1-yl)cyclohex-3-ene-1-carbonitrile CAS Name: 1-(4-fluorophenyl)-4-[4-(3-pyridazinyl)-1-piperazinyl]-1-cyclohex-3-enecarbonitrile IUPAC Name: 1-(4-fluorophenyl)-4-(4-pyridazin-3-ylpiperazin-1-yl)cyclohex-3-ene-1-carbonitrile Traditional Name: 1-(4-fluorophenyl)-4-(4-pyridazin-3-ylpiperazino)cyclohex-3-ene-1-carbonitrile Formula: C21H22FN5 MolecularWeight: 363.431283

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC=C1N2CCN(CC2)C3=NN=CC=C3)(C#N)C4=CC=C(C=C4)F

Isomeric SMILES

C1CC(CC=C1N2CCN(CC2)C3=NN=CC=C3)(C#N)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H22FN5/c22-18-5-3-17(4-6-18)21(16-23)9-7-19(8-10-21)26-12-14-27(15-13-26)20-2-1-11-24-25-20/h1-7,11H,8-10,12-15H2