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

Systemtic Name: 4-(3-chlorophenyl)-2-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 4-(3-chlorophenyl)-2-[[4-(2-pyridyl)piperazin-1-yl]methyl]-1,2,4-triazole-3-thione CAS Name: 4-(3-chlorophenyl)-2-[[4-(2-pyridinyl)-1-piperazinyl]methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-(3-chlorophenyl)-2-[(4-pyridin-2-ylpiperazin-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 4-(3-chlorophenyl)-2-[[4-(2-pyridyl)piperazino]methyl]-1,2,4-triazole-3-thione Formula: C18H19ClN6S MolecularWeight: 386.90166

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C(=S)N(C=N2)C3=CC(=CC=C3)Cl)C4=CC=CC=N4

Isomeric SMILES

C1CN(CCN1CN2C(=S)N(C=N2)C3=CC(=CC=C3)Cl)C4=CC=CC=N4

InChI

InChI=1S/C18H19ClN6S/c19-15-4-3-5-16(12-15)24-13-21-25(18(24)26)14-22-8-10-23(11-9-22)17-6-1-2-7-20-17/h1-7,12-13H,8-11,14H2