2-[(2-fluorophenyl)methyl]-5-(pyridin-2-ylmethylsulfanyl)-1,2,4-triazol-3-amine

Systemtic Name: 2-[(2-fluorophenyl)methyl]-5-(pyridin-2-ylmethylsulfanyl)-1,2,4-triazol-3-amine Openeye Name: 2-[(2-fluorophenyl)methyl]-5-(2-pyridylmethylsulfanyl)-1,2,4-triazol-3-amine CAS Name: 2-[(2-fluorophenyl)methyl]-5-(2-pyridinylmethylthio)-1,2,4-triazol-3-amine IUPAC Name: 2-[(2-fluorophenyl)methyl]-5-(pyridin-2-ylmethylsulfanyl)-1,2,4-triazol-3-amine Traditional Name: [2-(2-fluorobenzyl)-5-(2-pyridylmethylthio)-1,2,4-triazol-3-yl]amine Formula: C15H14FN5S MolecularWeight: 315.368563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C(=NC(=N2)SCC3=CC=CC=N3)N)F

Isomeric SMILES

C1=CC=C(C(=C1)CN2C(=NC(=N2)SCC3=CC=CC=N3)N)F

InChI

InChI=1S/C15H14FN5S/c16-13-7-2-1-5-11(13)9-21-14(17)19-15(20-21)22-10-12-6-3-4-8-18-12/h1-8H,9-10H2,(H2,17,19,20)