5-ethyl-3-[[4-fluoranyl-3-(3-pyridin-4-ylpyrrolidin-1-yl)carbonyl-phenyl]methyl]-1H-pyridazin-6-one

Systemtic Name: 5-ethyl-3-[[4-fluoranyl-3-(3-pyridin-4-ylpyrrolidin-1-yl)carbonyl-phenyl]methyl]-1H-pyridazin-6-one Openeye Name: 5-ethyl-3-[[4-fluoro-3-[3-(4-pyridyl)pyrrolidine-1-carbonyl]phenyl]methyl]-1H-pyridazin-6-one CAS Name: 5-ethyl-3-[[4-fluoro-3-[oxo-(3-pyridin-4-yl-1-pyrrolidinyl)methyl]phenyl]methyl]-1H-pyridazin-6-one IUPAC Name: 5-ethyl-3-[[4-fluoro-3-(3-pyridin-4-ylpyrrolidine-1-carbonyl)phenyl]methyl]-1H-pyridazin-6-one Traditional Name: 5-ethyl-3-[4-fluoro-3-[3-(4-pyridyl)pyrrolidine-1-carbonyl]benzyl]-1H-pyridazin-6-one Formula: C23H23FN4O2 MolecularWeight: 406.452723

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=NNC1=O)CC2=CC(=C(C=C2)F)C(=O)N3CCC(C3)C4=CC=NC=C4

Isomeric SMILES

CCC1=CC(=NNC1=O)CC2=CC(=C(C=C2)F)C(=O)N3CCC(C3)C4=CC=NC=C4

InChI

InChI=1S/C23H23FN4O2/c1-2-16-13-19(26-27-22(16)29)11-15-3-4-21(24)20(12-15)23(30)28-10-7-18(14-28)17-5-8-25-9-6-17/h3-6,8-9,12-13,18H,2,7,10-11,14H2,1H3,(H,27,29)