2-(3,5-ditert-butylphenyl)-5-(2-thiophen-2-ylquinolin-4-yl)-1,3,4-oxadiazole

Systemtic Name: 2-(3,5-ditert-butylphenyl)-5-(2-thiophen-2-ylquinolin-4-yl)-1,3,4-oxadiazole Openeye Name: 2-(3,5-ditert-butylphenyl)-5-[2-(2-thienyl)-4-quinolyl]-1,3,4-oxadiazole CAS Name: 2-(3,5-ditert-butylphenyl)-5-(2-thiophen-2-yl-4-quinolinyl)-1,3,4-oxadiazole IUPAC Name: 2-(3,5-ditert-butylphenyl)-5-(2-thiophen-2-ylquinolin-4-yl)-1,3,4-oxadiazole Traditional Name: 2-(3,5-ditert-butylphenyl)-5-[2-(2-thienyl)-4-quinolyl]-1,3,4-oxadiazole Formula: C29H29N3OS MolecularWeight: 467.62506

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1)C2=NN=C(O2)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1)C2=NN=C(O2)C3=CC(=NC4=CC=CC=C43)C5=CC=CS5)C(C)(C)C

InChI

InChI=1S/C29H29N3OS/c1-28(2,3)19-14-18(15-20(16-19)29(4,5)6)26-31-32-27(33-26)22-17-24(25-12-9-13-34-25)30-23-11-8-7-10-21(22)23/h7-17H,1-6H3