(4-fluorophenyl)-[1-[2-[2-(3-fluorophenyl)ethynyl]-6-methyl-pyridin-4-yl]carbonylpiperidin-4-yl]methanone

Systemtic Name: (4-fluorophenyl)-[1-[2-[2-(3-fluorophenyl)ethynyl]-6-methyl-pyridin-4-yl]carbonylpiperidin-4-yl]methanone Openeye Name: (4-fluorophenyl)-[1-[2-[2-(3-fluorophenyl)ethynyl]-6-methyl-pyridine-4-carbonyl]-4-piperidyl]methanone CAS Name: (4-fluorophenyl)-[1-[[2-[2-(3-fluorophenyl)ethynyl]-6-methyl-4-pyridinyl]-oxomethyl]-4-piperidinyl]methanone IUPAC Name: (4-fluorophenyl)-[1-[2-[2-(3-fluorophenyl)ethynyl]-6-methylpyridine-4-carbonyl]piperidin-4-yl]methanone Traditional Name: (4-fluorophenyl)-[1-[2-[2-(3-fluorophenyl)ethynyl]-6-methyl-isonicotinoyl]-4-piperidyl]methanone Formula: C27H22F2N2O2 MolecularWeight: 444.472586

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=C1)C(=O)N2CCC(CC2)C(=O)C3=CC=C(C=C3)F)C#CC4=CC(=CC=C4)F

Isomeric SMILES

CC1=NC(=CC(=C1)C(=O)N2CCC(CC2)C(=O)C3=CC=C(C=C3)F)C#CC4=CC(=CC=C4)F

InChI

InChI=1S/C27H22F2N2O2/c1-18-15-22(17-25(30-18)10-5-19-3-2-4-24(29)16-19)27(33)31-13-11-21(12-14-31)26(32)20-6-8-23(28)9-7-20/h2-4,6-9,15-17,21H,11-14H2,1H3