2-[2-[(5-naphthalen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethyl]isoindole-1,3-dione

Systemtic Name: 2-[2-[(5-naphthalen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethyl]isoindole-1,3-dione Openeye Name: 2-[2-[[5-(2-naphthyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethyl]isoindoline-1,3-dione CAS Name: 2-[2-[[5-(2-naphthalenyl)-1,3,4-oxadiazol-2-yl]thio]ethyl]isoindole-1,3-dione IUPAC Name: 2-[2-[(5-naphthalen-2-yl-1,3,4-oxadiazol-2-yl)sulfanyl]ethyl]isoindole-1,3-dione Traditional Name: 2-[2-[[5-(2-naphthyl)-1,3,4-oxadiazol-2-yl]thio]ethyl]isoindoline-1,3-quinone Formula: C22H15N3O3S MolecularWeight: 401.4378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)C3=NN=C(O3)SCCN4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)C3=NN=C(O3)SCCN4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C22H15N3O3S/c26-20-17-7-3-4-8-18(17)21(27)25(20)11-12-29-22-24-23-19(28-22)16-10-9-14-5-1-2-6-15(14)13-16/h1-10,13H,11-12H2