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

Systemtic Name: 4-(2-methylprop-2-enyl)-3-phenyl-1H-1,2,4-triazole-5-thione Openeye Name: 4-(2-methylallyl)-3-phenyl-1H-1,2,4-triazole-5-thione CAS Name: 4-(2-methylprop-2-enyl)-3-phenyl-1H-1,2,4-triazole-5-thione IUPAC Name: 4-(2-methylprop-2-enyl)-3-phenyl-1H-1,2,4-triazole-5-thione Traditional Name: 4-(2-methylallyl)-3-phenyl-1H-1,2,4-triazole-5-thione Formula: C12H13N3S MolecularWeight: 231.31672

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CN1C(=NNC1=S)C2=CC=CC=C2

Isomeric SMILES

CC(=C)CN1C(=NNC1=S)C2=CC=CC=C2

InChI

InChI=1S/C12H13N3S/c1-9(2)8-15-11(13-14-12(15)16)10-6-4-3-5-7-10/h3-7H,1,8H2,2H3,(H,14,16)