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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C)SCC2=NC(=NO2)C3=CC=CC=C3

Isomeric SMILES

CC1=NN=C(N1C)SCC2=NC(=NO2)C3=CC=CC=C3

InChI

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