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

Systemtic Name: 3-[3-(1H-benzimidazol-2-yl)piperidin-1-yl]carbonyl-6-methyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one Openeye Name: 3-[3-(1H-benzimidazol-2-yl)piperidine-1-carbonyl]-6-methyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one CAS Name: 3-[[3-(1H-benzimidazol-2-yl)-1-piperidinyl]-oxomethyl]-6-methyl-1-[2-(trifluoromethyl)phenyl]-4-pyridazinone IUPAC Name: 3-[3-(1H-benzimidazol-2-yl)piperidine-1-carbonyl]-6-methyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one Traditional Name: 3-[3-(1H-benzimidazol-2-yl)piperidine-1-carbonyl]-6-methyl-1-[2-(trifluoromethyl)phenyl]pyridazin-4-one Formula: C25H22F3N5O2 MolecularWeight: 481.46969

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=NN1C2=CC=CC=C2C(F)(F)F)C(=O)N3CCCC(C3)C4=NC5=CC=CC=C5N4

Isomeric SMILES

CC1=CC(=O)C(=NN1C2=CC=CC=C2C(F)(F)F)C(=O)N3CCCC(C3)C4=NC5=CC=CC=C5N4

InChI

InChI=1S/C25H22F3N5O2/c1-15-13-21(34)22(31-33(15)20-11-5-2-8-17(20)25(26,27)28)24(35)32-12-6-7-16(14-32)23-29-18-9-3-4-10-19(18)30-23/h2-5,8-11,13,16H,6-7,12,14H2,1H3,(H,29,30)