3-[4-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]carbonyl-5-(trifluoromethyl)pyrazol-1-yl]-1H-pyridazin-6-one

Systemtic Name: 3-[4-[4-(1H-benzimidazol-2-yl)piperidin-1-yl]carbonyl-5-(trifluoromethyl)pyrazol-1-yl]-1H-pyridazin-6-one Openeye Name: 3-[4-[4-(1H-benzimidazol-2-yl)piperidine-1-carbonyl]-5-(trifluoromethyl)pyrazol-1-yl]-1H-pyridazin-6-one CAS Name: 3-[4-[[4-(1H-benzimidazol-2-yl)-1-piperidinyl]-oxomethyl]-5-(trifluoromethyl)-1-pyrazolyl]-1H-pyridazin-6-one IUPAC Name: 3-[4-[4-(1H-benzimidazol-2-yl)piperidine-1-carbonyl]-5-(trifluoromethyl)pyrazol-1-yl]-1H-pyridazin-6-one Traditional Name: 3-[4-[4-(1H-benzimidazol-2-yl)piperidine-1-carbonyl]-5-(trifluoromethyl)pyrazol-1-yl]-1H-pyridazin-6-one Formula: C21H18F3N7O2 MolecularWeight: 457.40853

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3N2)C(=O)C4=C(N(N=C4)C5=NNC(=O)C=C5)C(F)(F)F

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3N2)C(=O)C4=C(N(N=C4)C5=NNC(=O)C=C5)C(F)(F)F

InChI

InChI=1S/C21H18F3N7O2/c22-21(23,24)18-13(11-25-31(18)16-5-6-17(32)29-28-16)20(33)30-9-7-12(8-10-30)19-26-14-3-1-2-4-15(14)27-19/h1-6,11-12H,7-10H2,(H,26,27)(H,29,32)