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

Systemtic Name: N-(2-pyridin-2-ylethyl)-6-[4-[2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]pyridazine-3-carboxamide Openeye Name: N-[2-(2-pyridyl)ethyl]-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridazine-3-carboxamide CAS Name: 6-[4-[oxo-[2-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]-N-[2-(2-pyridinyl)ethyl]-3-pyridazinecarboxamide IUPAC Name: N-(2-pyridin-2-ylethyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridazine-3-carboxamide Traditional Name: N-[2-(2-pyridyl)ethyl]-6-[4-[2-(trifluoromethyl)benzoyl]piperazino]pyridazine-3-carboxamide Formula: C24H23F3N6O2 MolecularWeight: 484.47363

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(C=C2)C(=O)NCCC3=CC=CC=N3)C(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=NN=C(C=C2)C(=O)NCCC3=CC=CC=N3)C(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C24H23F3N6O2/c25-24(26,27)19-7-2-1-6-18(19)23(35)33-15-13-32(14-16-33)21-9-8-20(30-31-21)22(34)29-12-10-17-5-3-4-11-28-17/h1-9,11H,10,12-16H2,(H,29,34)