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

Systemtic Name: 3-phenyl-5-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2,4-oxadiazole Openeye Name: 3-phenyl-5-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2,4-oxadiazole CAS Name: 3-phenyl-5-[[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]methyl]-1,2,4-oxadiazole IUPAC Name: 3-phenyl-5-[(5-phenyl-1H-1,2,4-triazol-3-yl)sulfanylmethyl]-1,2,4-oxadiazole Traditional Name: 3-phenyl-5-[[(5-phenyl-1H-1,2,4-triazol-3-yl)thio]methyl]-1,2,4-oxadiazole Formula: C17H13N5OS MolecularWeight: 335.38302

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NN2)SCC3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NN2)SCC3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C17H13N5OS/c1-3-7-12(8-4-1)15-19-17(21-20-15)24-11-14-18-16(22-23-14)13-9-5-2-6-10-13/h1-10H,11H2,(H,19,20,21)