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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NOC(=N2)CSC3=NN(C=N3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC2=NOC(=N2)CSC3=NN(C=N3)C4=CC=CC=C4

InChI

InChI=1S/C18H15N5OS/c1-3-7-14(8-4-1)11-16-20-17(24-22-16)12-25-18-19-13-23(21-18)15-9-5-2-6-10-15/h1-10,13H,11-12H2