4-ethyl-2-[[4-(2-methylphenyl)piperazin-1-yl]methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione

Systemtic Name: 4-ethyl-2-[[4-(2-methylphenyl)piperazin-1-yl]methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione Openeye Name: 4-ethyl-2-[[4-(o-tolyl)piperazin-1-yl]methyl]-5-(4-pyridyl)-1,2,4-triazole-3-thione CAS Name: 4-ethyl-2-[[4-(2-methylphenyl)-1-piperazinyl]methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione IUPAC Name: 4-ethyl-2-[[4-(2-methylphenyl)piperazin-1-yl]methyl]-5-pyridin-4-yl-1,2,4-triazole-3-thione Traditional Name: 4-ethyl-2-[[4-(o-tolyl)piperazino]methyl]-5-(4-pyridyl)-1,2,4-triazole-3-thione Formula: C21H26N6S MolecularWeight: 394.53634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=CC=C3C)C4=CC=NC=C4

Isomeric SMILES

CCN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=CC=C3C)C4=CC=NC=C4

InChI

InChI=1S/C21H26N6S/c1-3-26-20(18-8-10-22-11-9-18)23-27(21(26)28)16-24-12-14-25(15-13-24)19-7-5-4-6-17(19)2/h4-11H,3,12-16H2,1-2H3