5-(2,6-dimethylphenyl)sulfanyl-1H-1,2,4-triazole

Systemtic Name: 5-(2,6-dimethylphenyl)sulfanyl-1H-1,2,4-triazole Openeye Name: 5-(2,6-dimethylphenyl)sulfanyl-1H-1,2,4-triazole CAS Name: 5-[(2,6-dimethylphenyl)thio]-1H-1,2,4-triazole IUPAC Name: 5-(2,6-dimethylphenyl)sulfanyl-1H-1,2,4-triazole Traditional Name: 5-[(2,6-dimethylphenyl)thio]-1H-1,2,4-triazole Formula: C10H11N3S MolecularWeight: 205.27944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)SC2=NC=NN2

Isomeric SMILES

CC1=C(C(=CC=C1)C)SC2=NC=NN2

InChI

InChI=1S/C10H11N3S/c1-7-4-3-5-8(2)9(7)14-10-11-6-12-13-10/h3-6H,1-2H3,(H,11,12,13)