4-chloranyl-5-(3,5-dimethylpiperidin-1-yl)-2-[(4-fluorophenyl)methyl]pyridazin-3-one

Systemtic Name: 4-chloranyl-5-(3,5-dimethylpiperidin-1-yl)-2-[(4-fluorophenyl)methyl]pyridazin-3-one Openeye Name: 4-chloro-5-(3,5-dimethyl-1-piperidyl)-2-[(4-fluorophenyl)methyl]pyridazin-3-one CAS Name: 4-chloro-5-(3,5-dimethyl-1-piperidinyl)-2-[(4-fluorophenyl)methyl]-3-pyridazinone IUPAC Name: 4-chloro-5-(3,5-dimethylpiperidin-1-yl)-2-[(4-fluorophenyl)methyl]pyridazin-3-one Traditional Name: 4-chloro-5-(3,5-dimethylpiperidino)-2-(4-fluorobenzyl)pyridazin-3-one Formula: C18H21ClFN3O MolecularWeight: 349.830243

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=C(C(=O)N(N=C2)CC3=CC=C(C=C3)F)Cl)C

Isomeric SMILES

CC1CC(CN(C1)C2=C(C(=O)N(N=C2)CC3=CC=C(C=C3)F)Cl)C

InChI

InChI=1S/C18H21ClFN3O/c1-12-7-13(2)10-22(9-12)16-8-21-23(18(24)17(16)19)11-14-3-5-15(20)6-4-14/h3-6,8,12-13H,7,9-11H2,1-2H3