3-(3-methylphenyl)-4-(2-methylprop-2-enyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(3-methylphenyl)-4-(2-methylprop-2-enyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-(2-methylallyl)-3-(m-tolyl)-1H-1,2,4-triazole-5-thione CAS Name: 3-(3-methylphenyl)-4-(2-methylprop-2-enyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(3-methylphenyl)-4-(2-methylprop-2-enyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-(2-methylallyl)-3-(m-tolyl)-1H-1,2,4-triazole-5-thione Formula: C13H15N3S MolecularWeight: 245.3433

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NNC(=S)N2CC(=C)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=NNC(=S)N2CC(=C)C

InChI

InChI=1S/C13H15N3S/c1-9(2)8-16-12(14-15-13(16)17)11-6-4-5-10(3)7-11/h4-7H,1,8H2,2-3H3,(H,15,17)