5-[2-(2,6-dimethylphenoxy)ethylsulfanyl]-1H-1,2,4-triazole

Systemtic Name: 5-[2-(2,6-dimethylphenoxy)ethylsulfanyl]-1H-1,2,4-triazole Openeye Name: 5-[2-(2,6-dimethylphenoxy)ethylsulfanyl]-1H-1,2,4-triazole CAS Name: 5-[2-(2,6-dimethylphenoxy)ethylthio]-1H-1,2,4-triazole IUPAC Name: 5-[2-(2,6-dimethylphenoxy)ethylsulfanyl]-1H-1,2,4-triazole Traditional Name: 5-[2-(2,6-dimethylphenoxy)ethylthio]-1H-1,2,4-triazole Formula: C12H15N3OS MolecularWeight: 249.332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OCCSC2=NC=NN2

Isomeric SMILES

CC1=C(C(=CC=C1)C)OCCSC2=NC=NN2

InChI

InChI=1S/C12H15N3OS/c1-9-4-3-5-10(2)11(9)16-6-7-17-12-13-8-14-15-12/h3-5,8H,6-7H2,1-2H3,(H,13,14,15)