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

Systemtic Name: 5-[(4-ethyl-5-phenethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(2-methylphenyl)-1,2,4-oxadiazole Openeye Name: 5-[(4-ethyl-5-phenethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(o-tolyl)-1,2,4-oxadiazole CAS Name: 5-[[(4-ethyl-5-phenethyl-1,2,4-triazol-3-yl)thio]methyl]-3-(2-methylphenyl)-1,2,4-oxadiazole IUPAC Name: 5-[(4-ethyl-5-phenethyl-1,2,4-triazol-3-yl)sulfanylmethyl]-3-(2-methylphenyl)-1,2,4-oxadiazole Traditional Name: 5-[[(4-ethyl-5-phenethyl-1,2,4-triazol-3-yl)thio]methyl]-3-(o-tolyl)-1,2,4-oxadiazole Formula: C22H23N5OS MolecularWeight: 405.51592

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC2=NC(=NO2)C3=CC=CC=C3C)CCC4=CC=CC=C4

Isomeric SMILES

CCN1C(=NN=C1SCC2=NC(=NO2)C3=CC=CC=C3C)CCC4=CC=CC=C4

InChI

InChI=1S/C22H23N5OS/c1-3-27-19(14-13-17-10-5-4-6-11-17)24-25-22(27)29-15-20-23-21(26-28-20)18-12-8-7-9-16(18)2/h4-12H,3,13-15H2,1-2H3