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

Systemtic Name: N-pyridin-3-yl-6-[4-[2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]pyridazine-3-carboxamide Openeye Name: N-(3-pyridyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridazine-3-carboxamide CAS Name: 6-[4-[oxo-[2-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]-N-(3-pyridinyl)-3-pyridazinecarboxamide IUPAC Name: N-pyridin-3-yl-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridazine-3-carboxamide Traditional Name: N-(3-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=CN=CC=C3)C(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

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

InChI

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