4-(3,5-dimethylphenyl)-3-propyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-(3,5-dimethylphenyl)-3-propyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-(3,5-dimethylphenyl)-3-propyl-1H-1,2,4-triazole-5-thione CAS Name: 4-(3,5-dimethylphenyl)-3-propyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(3,5-dimethylphenyl)-3-propyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-(3,5-dimethylphenyl)-3-propyl-1H-1,2,4-triazole-5-thione Formula: C13H17N3S MolecularWeight: 247.35918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1C2=CC(=CC(=C2)C)C

Isomeric SMILES

CCCC1=NNC(=S)N1C2=CC(=CC(=C2)C)C

InChI

InChI=1S/C13H17N3S/c1-4-5-12-14-15-13(17)16(12)11-7-9(2)6-10(3)8-11/h6-8H,4-5H2,1-3H3,(H,15,17)