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

Systemtic Name: N-pyridin-4-yl-6-[4-[2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]pyridazine-3-carboxamide Openeye Name: N-(4-pyridyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridazine-3-carboxamide CAS Name: 6-[4-[oxo-[2-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]-N-pyridin-4-yl-3-pyridazinecarboxamide IUPAC Name: N-pyridin-4-yl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridazine-3-carboxamide Traditional Name: N-(4-pyridyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazino]pyridazine-3-carboxamide Formula: C22H19F3N6O2 MolecularWeight: 456.42047

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NN=C(C=C2)C(=O)NC3=CC=NC=C3)C(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1CN(CCN1C2=NN=C(C=C2)C(=O)NC3=CC=NC=C3)C(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C22H19F3N6O2/c23-22(24,25)17-4-2-1-3-16(17)21(33)31-13-11-30(12-14-31)19-6-5-18(28-29-19)20(32)27-15-7-9-26-10-8-15/h1-10H,11-14H2,(H,26,27,32)