1-[3-[2-(4-phenylphthalazin-1-yl)sulfanylethanoyl]phenyl]pyrrolidin-2-one

Systemtic Name: 1-[3-[2-(4-phenylphthalazin-1-yl)sulfanylethanoyl]phenyl]pyrrolidin-2-one Openeye Name: 1-[3-[2-(4-phenylphthalazin-1-yl)sulfanylacetyl]phenyl]pyrrolidin-2-one CAS Name: 1-[3-[1-oxo-2-[(4-phenyl-1-phthalazinyl)thio]ethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[3-[2-(4-phenylphthalazin-1-yl)sulfanylacetyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[3-[2-[(4-phenylphthalazin-1-yl)thio]acetyl]phenyl]-2-pyrrolidone Formula: C26H21N3O2S MolecularWeight: 439.52884

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=CC(=C2)C(=O)CSC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=CC(=C2)C(=O)CSC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C26H21N3O2S/c30-23(19-10-6-11-20(16-19)29-15-7-14-24(29)31)17-32-26-22-13-5-4-12-21(22)25(27-28-26)18-8-2-1-3-9-18/h1-6,8-13,16H,7,14-15,17H2