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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NN=C(N3CC)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NOC(=N2)CSC3=NN=C(N3CC)C4=CC=CC=C4

InChI

InChI=1S/C21H21N5OS/c1-3-15-10-12-16(13-11-15)19-22-18(27-25-19)14-28-21-24-23-20(26(21)4-2)17-8-6-5-7-9-17/h5-13H,3-4,14H2,1-2H3