5-(4-methylphenyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1,2,4-oxadiazole

Systemtic Name: 5-(4-methylphenyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1,2,4-oxadiazole Openeye Name: 5-(p-tolyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1,2,4-oxadiazole CAS Name: 5-(4-methylphenyl)-3-[(1H-1,2,4-triazol-5-ylthio)methyl]-1,2,4-oxadiazole IUPAC Name: 5-(4-methylphenyl)-3-(1H-1,2,4-triazol-5-ylsulfanylmethyl)-1,2,4-oxadiazole Traditional Name: 5-(p-tolyl)-3-[(1H-1,2,4-triazol-5-ylthio)methyl]-1,2,4-oxadiazole Formula: C12H11N5OS MolecularWeight: 273.31364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NO2)CSC3=NC=NN3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NO2)CSC3=NC=NN3

InChI

InChI=1S/C12H11N5OS/c1-8-2-4-9(5-3-8)11-15-10(17-18-11)6-19-12-13-7-14-16-12/h2-5,7H,6H2,1H3,(H,13,14,16)