2-[1-(4-fluorophenyl)-4-propan-2-yl-pyrazolo[3,4-d]pyridazin-7-yl]sulfanylethanamide

Systemtic Name: 2-[1-(4-fluorophenyl)-4-propan-2-yl-pyrazolo[3,4-d]pyridazin-7-yl]sulfanylethanamide Openeye Name: 2-[1-(4-fluorophenyl)-4-isopropyl-pyrazolo[3,4-d]pyridazin-7-yl]sulfanylacetamide CAS Name: 2-[[1-(4-fluorophenyl)-4-propan-2-yl-7-pyrazolo[3,4-d]pyridazinyl]thio]acetamide IUPAC Name: 2-[1-(4-fluorophenyl)-4-propan-2-ylpyrazolo[3,4-d]pyridazin-7-yl]sulfanylacetamide Traditional Name: 2-[[1-(4-fluorophenyl)-4-isopropyl-pyrazolo[3,4-d]pyridazin-7-yl]thio]acetamide Formula: C16H16FN5OS MolecularWeight: 345.394543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN=C(C2=C1C=NN2C3=CC=C(C=C3)F)SCC(=O)N

Isomeric SMILES

CC(C)C1=NN=C(C2=C1C=NN2C3=CC=C(C=C3)F)SCC(=O)N

InChI

InChI=1S/C16H16FN5OS/c1-9(2)14-12-7-19-22(11-5-3-10(17)4-6-11)15(12)16(21-20-14)24-8-13(18)23/h3-7,9H,8H2,1-2H3,(H2,18,23)