2-(4-tert-butylphenyl)-5-[5-(2-pyrazin-2-ylethynyl)thiophen-2-yl]-1,3,4-oxadiazole

Systemtic Name: 2-(4-tert-butylphenyl)-5-[5-(2-pyrazin-2-ylethynyl)thiophen-2-yl]-1,3,4-oxadiazole Openeye Name: 2-(4-tert-butylphenyl)-5-[5-(2-pyrazin-2-ylethynyl)-2-thienyl]-1,3,4-oxadiazole CAS Name: 2-(4-tert-butylphenyl)-5-[5-[2-(2-pyrazinyl)ethynyl]-2-thiophenyl]-1,3,4-oxadiazole IUPAC Name: 2-(4-tert-butylphenyl)-5-[5-(2-pyrazin-2-ylethynyl)thiophen-2-yl]-1,3,4-oxadiazole Traditional Name: 2-(4-tert-butylphenyl)-5-[5-(2-pyrazin-2-ylethynyl)-2-thienyl]-1,3,4-oxadiazole Formula: C22H18N4OS MolecularWeight: 386.46952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(O2)C3=CC=C(S3)C#CC4=NC=CN=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(O2)C3=CC=C(S3)C#CC4=NC=CN=C4

InChI

InChI=1S/C22H18N4OS/c1-22(2,3)16-6-4-15(5-7-16)20-25-26-21(27-20)19-11-10-18(28-19)9-8-17-14-23-12-13-24-17/h4-7,10-14H,1-3H3