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

Systemtic Name: 3-(2-ethoxyphenyl)-5-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2,4-oxadiazole Openeye Name: 3-(2-ethoxyphenyl)-5-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2,4-oxadiazole CAS Name: 3-(2-ethoxyphenyl)-5-[[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]methyl]-1,2,4-oxadiazole IUPAC Name: 3-(2-ethoxyphenyl)-5-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2,4-oxadiazole Traditional Name: 5-[[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]methyl]-3-o-phenetyl-1,2,4-oxadiazole Formula: C21H21N5O2S MolecularWeight: 407.48874

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=NC(=NO2)C3=CC=CC=C3OCC)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=NN=C1SCC2=NC(=NO2)C3=CC=CC=C3OCC)C4=CC=CC=C4

InChI

InChI=1S/C21H21N5O2S/c1-3-26-20(15-10-6-5-7-11-15)23-24-21(26)29-14-18-22-19(25-28-18)16-12-8-9-13-17(16)27-4-2/h5-13H,3-4,14H2,1-2H3