2-(diethylaminomethyl)-5-[(E)-2-(2-methylphenyl)ethenyl]-1H-1,2,4-triazole-3-thione

Systemtic Name: 2-(diethylaminomethyl)-5-[(E)-2-(2-methylphenyl)ethenyl]-1H-1,2,4-triazole-3-thione Openeye Name: 2-(diethylaminomethyl)-5-[(E)-2-(o-tolyl)vinyl]-1H-1,2,4-triazole-3-thione CAS Name: 2-(diethylaminomethyl)-5-[(E)-2-(2-methylphenyl)ethenyl]-1H-1,2,4-triazole-3-thione IUPAC Name: 2-(diethylaminomethyl)-5-[(E)-2-(2-methylphenyl)ethenyl]-1H-1,2,4-triazole-3-thione Traditional Name: 2-(diethylaminomethyl)-5-[(E)-2-(o-tolyl)vinyl]-1H-1,2,4-triazole-3-thione Formula: C16H22N4S MolecularWeight: 302.43768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CN1C(=S)N=C(N1)C=CC2=CC=CC=C2C

Isomeric SMILES

CCN(CC)CN1C(=S)N=C(N1)/C=C/C2=CC=CC=C2C

InChI

InChI=1S/C16H22N4S/c1-4-19(5-2)12-20-16(21)17-15(18-20)11-10-14-9-7-6-8-13(14)3/h6-11H,4-5,12H2,1-3H3,(H,17,18,21)/b11-10+