4-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]-N-(4-fluorophenyl)piperazine-1-carboxamide

Systemtic Name: 4-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]-N-(4-fluorophenyl)piperazine-1-carboxamide Openeye Name: 4-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]-N-(4-fluorophenyl)piperazine-1-carboxamide CAS Name: 4-[6-(3,5-dimethyl-1-pyrazolyl)-3-pyridazinyl]-N-(4-fluorophenyl)-1-piperazinecarboxamide IUPAC Name: 4-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]-N-(4-fluorophenyl)piperazine-1-carboxamide Traditional Name: 4-[6-(3,5-dimethylpyrazol-1-yl)pyridazin-3-yl]-N-(4-fluorophenyl)piperazine-1-carboxamide Formula: C20H22FN7O MolecularWeight: 395.433383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=NN=C(C=C2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)F)C

Isomeric SMILES

CC1=CC(=NN1C2=NN=C(C=C2)N3CCN(CC3)C(=O)NC4=CC=C(C=C4)F)C

InChI

InChI=1S/C20H22FN7O/c1-14-13-15(2)28(25-14)19-8-7-18(23-24-19)26-9-11-27(12-10-26)20(29)22-17-5-3-16(21)4-6-17/h3-8,13H,9-12H2,1-2H3,(H,22,29)