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

Systemtic Name: 4-ethyl-5-pyridin-4-yl-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 4-ethyl-5-(4-pyridyl)-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione CAS Name: 4-ethyl-5-pyridin-4-yl-2-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-ethyl-5-pyridin-4-yl-2-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 4-ethyl-5-(4-pyridyl)-2-[[4-(2-pyrimidyl)piperazino]methyl]-1,2,4-triazole-3-thione Formula: C18H22N8S MolecularWeight: 382.48588

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)CN2CCN(CC2)C3=NC=CC=N3)C4=CC=NC=C4

Isomeric SMILES

CCN1C(=NN(C1=S)CN2CCN(CC2)C3=NC=CC=N3)C4=CC=NC=C4

InChI

InChI=1S/C18H22N8S/c1-2-25-16(15-4-8-19-9-5-15)22-26(18(25)27)14-23-10-12-24(13-11-23)17-20-6-3-7-21-17/h3-9H,2,10-14H2,1H3