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

Systemtic Name: 5-(4-methylphenyl)-3-[(1-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2,4-oxadiazole Openeye Name: 3-[(1-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-5-(p-tolyl)-1,2,4-oxadiazole CAS Name: 5-(4-methylphenyl)-3-[[(1-phenyl-1,2,4-triazol-3-yl)thio]methyl]-1,2,4-oxadiazole IUPAC Name: 5-(4-methylphenyl)-3-[(1-phenyl-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2,4-oxadiazole Traditional Name: 3-[[(1-phenyl-1,2,4-triazol-3-yl)thio]methyl]-5-(p-tolyl)-1,2,4-oxadiazole Formula: C18H15N5OS MolecularWeight: 349.4096

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NO2)CSC3=NN(C=N3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NO2)CSC3=NN(C=N3)C4=CC=CC=C4

InChI

InChI=1S/C18H15N5OS/c1-13-7-9-14(10-8-13)17-20-16(22-24-17)11-25-18-19-12-23(21-18)15-5-3-2-4-6-15/h2-10,12H,11H2,1H3