4-(2-methoxyethyl)-5-pyridin-4-yl-2-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione

Systemtic Name: 4-(2-methoxyethyl)-5-pyridin-4-yl-2-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 4-(2-methoxyethyl)-5-(4-pyridyl)-2-[[4-(2-pyridyl)piperazin-1-yl]methyl]-1,2,4-triazole-3-thione CAS Name: 4-(2-methoxyethyl)-5-pyridin-4-yl-2-[[4-(2-pyridinyl)-1-piperazinyl]methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-(2-methoxyethyl)-5-pyridin-4-yl-2-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 4-(2-methoxyethyl)-5-(4-pyridyl)-2-[[4-(2-pyridyl)piperazino]methyl]-1,2,4-triazole-3-thione Formula: C20H25N7OS MolecularWeight: 411.5238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=CC=N3)C4=CC=NC=C4

Isomeric SMILES

COCCN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=CC=N3)C4=CC=NC=C4

InChI

InChI=1S/C20H25N7OS/c1-28-15-14-26-19(17-5-8-21-9-6-17)23-27(20(26)29)16-24-10-12-25(13-11-24)18-4-2-3-7-22-18/h2-9H,10-16H2,1H3