6-ethanoyl-4-(4-fluorophenyl)sulfanyl-5-methyl-2-(1-oxidanidylpyridin-1-ium-3-yl)pyridazin-3-one

Systemtic Name: 6-ethanoyl-4-(4-fluorophenyl)sulfanyl-5-methyl-2-(1-oxidanidylpyridin-1-ium-3-yl)pyridazin-3-one Openeye Name: 6-acetyl-4-(4-fluorophenyl)sulfanyl-5-methyl-2-(1-oxidopyridin-1-ium-3-yl)pyridazin-3-one CAS Name: 6-acetyl-4-[(4-fluorophenyl)thio]-5-methyl-2-(1-oxido-3-pyridin-1-iumyl)-3-pyridazinone IUPAC Name: 6-acetyl-4-(4-fluorophenyl)sulfanyl-5-methyl-2-(1-oxidopyridin-1-ium-3-yl)pyridazin-3-one Traditional Name: 6-acetyl-4-[(4-fluorophenyl)thio]-5-methyl-2-(1-oxidopyridin-1-ium-3-yl)pyridazin-3-one Formula: C18H14FN3O3S MolecularWeight: 371.385463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(N=C1C(=O)C)C2=C[N+](=CC=C2)[O-])SC3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(C(=O)N(N=C1C(=O)C)C2=C[N+](=CC=C2)[O-])SC3=CC=C(C=C3)F

InChI

InChI=1S/C18H14FN3O3S/c1-11-16(12(2)23)20-22(14-4-3-9-21(25)10-14)18(24)17(11)26-15-7-5-13(19)6-8-15/h3-10H,1-2H3