2-[1-(4-fluorophenyl)-4-methyl-pyrazolo[3,4-d]pyridazin-7-yl]sulfanyl-N-methyl-ethanamide

Systemtic Name: 2-[1-(4-fluorophenyl)-4-methyl-pyrazolo[3,4-d]pyridazin-7-yl]sulfanyl-N-methyl-ethanamide Openeye Name: 2-[1-(4-fluorophenyl)-4-methyl-pyrazolo[3,4-d]pyridazin-7-yl]sulfanyl-N-methyl-acetamide CAS Name: 2-[[1-(4-fluorophenyl)-4-methyl-7-pyrazolo[3,4-d]pyridazinyl]thio]-N-methylacetamide IUPAC Name: 2-[1-(4-fluorophenyl)-4-methylpyrazolo[3,4-d]pyridazin-7-yl]sulfanyl-N-methylacetamide Traditional Name: 2-[[1-(4-fluorophenyl)-4-methyl-pyrazolo[3,4-d]pyridazin-7-yl]thio]-N-methyl-acetamide Formula: C15H14FN5OS MolecularWeight: 331.367963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(C2=C1C=NN2C3=CC=C(C=C3)F)SCC(=O)NC

Isomeric SMILES

CC1=NN=C(C2=C1C=NN2C3=CC=C(C=C3)F)SCC(=O)NC

InChI

InChI=1S/C15H14FN5OS/c1-9-12-7-18-21(11-5-3-10(16)4-6-11)14(12)15(20-19-9)23-8-13(22)17-2/h3-7H,8H2,1-2H3,(H,17,22)