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

Systemtic Name: 2-methyl-5-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3,4-oxadiazole Openeye Name: 2-methyl-5-[[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3,4-oxadiazole CAS Name: 2-methyl-5-[[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]thio]methyl]-1,3,4-oxadiazole IUPAC Name: 2-methyl-5-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3,4-oxadiazole Traditional Name: 2-methyl-5-[[[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]thio]methyl]-1,3,4-oxadiazole Formula: C13H13N5OS MolecularWeight: 287.34022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NN2)SCC3=NN=C(O3)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NN2)SCC3=NN=C(O3)C

InChI

InChI=1S/C13H13N5OS/c1-8-3-5-10(6-4-8)12-14-13(18-17-12)20-7-11-16-15-9(2)19-11/h3-6H,7H2,1-2H3,(H,14,17,18)