2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-1-(2-thiophen-2-ylpyrrolidin-1-yl)ethanone

Systemtic Name: 2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-1-(2-thiophen-2-ylpyrrolidin-1-yl)ethanone Openeye Name: 2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-1-[2-(2-thienyl)pyrrolidin-1-yl]ethanone CAS Name: 2-[[4-(4-fluorophenyl)-1-phthalazinyl]thio]-1-(2-thiophen-2-yl-1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-(4-fluorophenyl)phthalazin-1-yl]sulfanyl-1-(2-thiophen-2-ylpyrrolidin-1-yl)ethanone Traditional Name: 2-[[4-(4-fluorophenyl)phthalazin-1-yl]thio]-1-[2-(2-thienyl)pyrrolidino]ethanone Formula: C24H20FN3OS2 MolecularWeight: 449.563503

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)F)C5=CC=CS5

Isomeric SMILES

C1CC(N(C1)C(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=C(C=C4)F)C5=CC=CS5

InChI

InChI=1S/C24H20FN3OS2/c25-17-11-9-16(10-12-17)23-18-5-1-2-6-19(18)24(27-26-23)31-15-22(29)28-13-3-7-20(28)21-8-4-14-30-21/h1-2,4-6,8-12,14,20H,3,7,13,15H2