N-(2-propan-2-ylphenyl)-6-[4-[2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]pyridazine-3-carboxamide

Systemtic Name: N-(2-propan-2-ylphenyl)-6-[4-[2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]pyridazine-3-carboxamide Openeye Name: N-(2-isopropylphenyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridazine-3-carboxamide CAS Name: 6-[4-[oxo-[2-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]-N-(2-propan-2-ylphenyl)-3-pyridazinecarboxamide IUPAC Name: N-(2-propan-2-ylphenyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridazine-3-carboxamide Traditional Name: N-o-cumenyl-6-[4-[2-(trifluoromethyl)benzoyl]piperazino]pyridazine-3-carboxamide Formula: C26H26F3N5O2 MolecularWeight: 497.51215

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1NC(=O)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

CC(C)C1=CC=CC=C1NC(=O)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C26H26F3N5O2/c1-17(2)18-7-4-6-10-21(18)30-24(35)22-11-12-23(32-31-22)33-13-15-34(16-14-33)25(36)19-8-3-5-9-20(19)26(27,28)29/h3-12,17H,13-16H2,1-2H3,(H,30,35)