2-[2-(2-fluorophenyl)-3,4-diphenyl-pyrazolo[3,4-d]pyridazin-7-yl]sulfanylethanamide

Systemtic Name: 2-[2-(2-fluorophenyl)-3,4-diphenyl-pyrazolo[3,4-d]pyridazin-7-yl]sulfanylethanamide Openeye Name: 2-[2-(2-fluorophenyl)-3,4-diphenyl-pyrazolo[3,4-d]pyridazin-7-yl]sulfanylacetamide CAS Name: 2-[[2-(2-fluorophenyl)-3,4-diphenyl-7-pyrazolo[3,4-d]pyridazinyl]thio]acetamide IUPAC Name: 2-[2-(2-fluorophenyl)-3,4-diphenylpyrazolo[3,4-d]pyridazin-7-yl]sulfanylacetamide Traditional Name: 2-[[2-(2-fluorophenyl)-3,4-diphenyl-pyrazolo[3,4-d]pyridazin-7-yl]thio]acetamide Formula: C25H18FN5OS MolecularWeight: 455.506723

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C(=NN=C(C3=NN2C4=CC=CC=C4F)SCC(=O)N)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C(=NN=C(C3=NN2C4=CC=CC=C4F)SCC(=O)N)C5=CC=CC=C5

InChI

InChI=1S/C25H18FN5OS/c26-18-13-7-8-14-19(18)31-24(17-11-5-2-6-12-17)21-22(16-9-3-1-4-10-16)28-29-25(23(21)30-31)33-15-20(27)32/h1-14H,15H2,(H2,27,32)