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

Systemtic Name: 2-[[(3-fluorophenyl)methyl-methyl-amino]methyl]-4-phenyl-5-pyridin-4-yl-1,2,4-triazole-3-thione Openeye Name: 2-[[(3-fluorophenyl)methyl-methyl-amino]methyl]-4-phenyl-5-(4-pyridyl)-1,2,4-triazole-3-thione CAS Name: 2-[[(3-fluorophenyl)methyl-methylamino]methyl]-4-phenyl-5-pyridin-4-yl-1,2,4-triazole-3-thione IUPAC Name: 2-[[(3-fluorophenyl)methyl-methylamino]methyl]-4-phenyl-5-pyridin-4-yl-1,2,4-triazole-3-thione Traditional Name: 2-[[(3-fluorobenzyl)-methyl-amino]methyl]-4-phenyl-5-(4-pyridyl)-1,2,4-triazole-3-thione Formula: C22H20FN5S MolecularWeight: 405.491103

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC(=CC=C1)F)CN2C(=S)N(C(=N2)C3=CC=NC=C3)C4=CC=CC=C4

Isomeric SMILES

CN(CC1=CC(=CC=C1)F)CN2C(=S)N(C(=N2)C3=CC=NC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H20FN5S/c1-26(15-17-6-5-7-19(23)14-17)16-27-22(29)28(20-8-3-2-4-9-20)21(25-27)18-10-12-24-13-11-18/h2-14H,15-16H2,1H3