5-[3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]propyl]-3-phenyl-1,2,4-oxadiazole

Systemtic Name: 5-[3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]propyl]-3-phenyl-1,2,4-oxadiazole Openeye Name: 5-[3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]propyl]-3-phenyl-1,2,4-oxadiazole CAS Name: 5-[3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]propyl]-3-phenyl-1,2,4-oxadiazole IUPAC Name: 5-[3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]propyl]-3-phenyl-1,2,4-oxadiazole Traditional Name: 5-[3-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]propyl]-3-phenyl-1,2,4-oxadiazole Formula: C21H21N5OS MolecularWeight: 391.48934

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCCCC2=NC(=NO2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=NN=C1SCCCC2=NC(=NO2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H21N5OS/c1-2-26-20(17-12-7-4-8-13-17)23-24-21(26)28-15-9-14-18-22-19(25-27-18)16-10-5-3-6-11-16/h3-8,10-13H,2,9,14-15H2,1H3