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

Systemtic Name: 4-ethyl-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-5-phenyl-1,2,4-triazole-3-thione Openeye Name: 4-ethyl-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-5-phenyl-1,2,4-triazole-3-thione CAS Name: 4-ethyl-2-[[4-(4-fluorophenyl)-1-piperazinyl]methyl]-5-phenyl-1,2,4-triazole-3-thione IUPAC Name: 4-ethyl-2-[[4-(4-fluorophenyl)piperazin-1-yl]methyl]-5-phenyl-1,2,4-triazole-3-thione Traditional Name: 4-ethyl-2-[[4-(4-fluorophenyl)piperazino]methyl]-5-phenyl-1,2,4-triazole-3-thione Formula: C21H24FN5S MolecularWeight: 397.512163

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=C(C=C3)F)C4=CC=CC=C4

Isomeric SMILES

CCN1C(=NN(C1=S)CN2CCN(CC2)C3=CC=C(C=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C21H24FN5S/c1-2-26-20(17-6-4-3-5-7-17)23-27(21(26)28)16-24-12-14-25(15-13-24)19-10-8-18(22)9-11-19/h3-11H,2,12-16H2,1H3