3-[(4-chlorophenyl)methyl]-4-methyl-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-[(4-chlorophenyl)methyl]-4-methyl-1H-1,2,4-triazole-5-thione Openeye Name: 3-[(4-chlorophenyl)methyl]-4-methyl-1H-1,2,4-triazole-5-thione CAS Name: 3-[(4-chlorophenyl)methyl]-4-methyl-1H-1,2,4-triazole-5-thione IUPAC Name: 3-[(4-chlorophenyl)methyl]-4-methyl-1H-1,2,4-triazole-5-thione Traditional Name: 3-(4-chlorobenzyl)-4-methyl-1H-1,2,4-triazole-5-thione Formula: C10H10ClN3S MolecularWeight: 239.7245

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NNC1=S)CC2=CC=C(C=C2)Cl

Isomeric SMILES

CN1C(=NNC1=S)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C10H10ClN3S/c1-14-9(12-13-10(14)15)6-7-2-4-8(11)5-3-7/h2-5H,6H2,1H3,(H,13,15)