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

Systemtic Name: 1-[4-[2-(4-phenylphthalazin-1-yl)sulfanylethanoyl]phenyl]pyrrolidin-2-one Openeye Name: 1-[4-[2-(4-phenylphthalazin-1-yl)sulfanylacetyl]phenyl]pyrrolidin-2-one CAS Name: 1-[4-[1-oxo-2-[(4-phenyl-1-phthalazinyl)thio]ethyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[4-[2-(4-phenylphthalazin-1-yl)sulfanylacetyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[4-[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=C(C=C2)C(=O)CSC3=NN=C(C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

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

InChI

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