2-tert-butyl-4-chloranyl-5-[[6-[(4-fluorophenyl)methoxy]pyridin-3-yl]methoxy]pyridazin-3-one

Systemtic Name: 2-tert-butyl-4-chloranyl-5-[[6-[(4-fluorophenyl)methoxy]pyridin-3-yl]methoxy]pyridazin-3-one Openeye Name: 2-tert-butyl-4-chloro-5-[[6-[(4-fluorophenyl)methoxy]-3-pyridyl]methoxy]pyridazin-3-one CAS Name: 2-tert-butyl-4-chloro-5-[[6-[(4-fluorophenyl)methoxy]-3-pyridinyl]methoxy]-3-pyridazinone IUPAC Name: 2-tert-butyl-4-chloro-5-[[6-[(4-fluorophenyl)methoxy]pyridin-3-yl]methoxy]pyridazin-3-one Traditional Name: 2-tert-butyl-4-chloro-5-[[6-(4-fluorobenzyl)oxy-3-pyridyl]methoxy]pyridazin-3-one Formula: C21H21ClFN3O3 MolecularWeight: 417.861143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C(=O)C(=C(C=N1)OCC2=CN=C(C=C2)OCC3=CC=C(C=C3)F)Cl

Isomeric SMILES

CC(C)(C)N1C(=O)C(=C(C=N1)OCC2=CN=C(C=C2)OCC3=CC=C(C=C3)F)Cl

InChI

InChI=1S/C21H21ClFN3O3/c1-21(2,3)26-20(27)19(22)17(11-25-26)28-13-15-6-9-18(24-10-15)29-12-14-4-7-16(23)8-5-14/h4-11H,12-13H2,1-3H3