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

Systemtic Name: 4-(4-fluorophenyl)-5-pyridin-4-yl-2-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]-1,2,4-triazole-3-thione Openeye Name: 4-(4-fluorophenyl)-5-(4-pyridyl)-2-[[2-(3-pyridyl)pyrrolidin-1-yl]methyl]-1,2,4-triazole-3-thione CAS Name: 4-(4-fluorophenyl)-5-pyridin-4-yl-2-[[2-(3-pyridinyl)-1-pyrrolidinyl]methyl]-1,2,4-triazole-3-thione IUPAC Name: 4-(4-fluorophenyl)-5-pyridin-4-yl-2-[(2-pyridin-3-ylpyrrolidin-1-yl)methyl]-1,2,4-triazole-3-thione Traditional Name: 4-(4-fluorophenyl)-5-(4-pyridyl)-2-[[2-(3-pyridyl)pyrrolidino]methyl]-1,2,4-triazole-3-thione Formula: C23H21FN6S MolecularWeight: 432.516443

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)CN2C(=S)N(C(=N2)C3=CC=NC=C3)C4=CC=C(C=C4)F)C5=CN=CC=C5

Isomeric SMILES

C1CC(N(C1)CN2C(=S)N(C(=N2)C3=CC=NC=C3)C4=CC=C(C=C4)F)C5=CN=CC=C5

InChI

InChI=1S/C23H21FN6S/c24-19-5-7-20(8-6-19)30-22(17-9-12-25-13-10-17)27-29(23(30)31)16-28-14-2-4-21(28)18-3-1-11-26-15-18/h1,3,5-13,15,21H,2,4,14,16H2