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

Systemtic Name: N-(4-methylpyrimidin-2-yl)-6-[4-[2-(trifluoromethyl)phenyl]carbonylpiperazin-1-yl]pyridazine-3-carboxamide Openeye Name: N-(4-methylpyrimidin-2-yl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridazine-3-carboxamide CAS Name: N-(4-methyl-2-pyrimidinyl)-6-[4-[oxo-[2-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]-3-pyridazinecarboxamide IUPAC Name: N-(4-methylpyrimidin-2-yl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridazine-3-carboxamide Traditional Name: N-(4-methylpyrimidin-2-yl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazino]pyridazine-3-carboxamide Formula: C22H20F3N7O2 MolecularWeight: 471.43511

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)NC(=O)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

CC1=NC(=NC=C1)NC(=O)C2=NN=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C22H20F3N7O2/c1-14-8-9-26-21(27-14)28-19(33)17-6-7-18(30-29-17)31-10-12-32(13-11-31)20(34)15-4-2-3-5-16(15)22(23,24)25/h2-9H,10-13H2,1H3,(H,26,27,28,33)