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

Systemtic Name: 3-[(2-fluorophenyl)methyl]-5-(2-pyridin-2-ylethylsulfanyl)-1,2,4-triazol-4-amine Openeye Name: 3-[(2-fluorophenyl)methyl]-5-[2-(2-pyridyl)ethylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-[(2-fluorophenyl)methyl]-5-[2-(2-pyridinyl)ethylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-[(2-fluorophenyl)methyl]-5-(2-pyridin-2-ylethylsulfanyl)-1,2,4-triazol-4-amine Traditional Name: [3-(2-fluorobenzyl)-5-[2-(2-pyridyl)ethylthio]-1,2,4-triazol-4-yl]amine Formula: C16H16FN5S MolecularWeight: 329.395143

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC2=NN=C(N2N)SCCC3=CC=CC=N3)F

Isomeric SMILES

C1=CC=C(C(=C1)CC2=NN=C(N2N)SCCC3=CC=CC=N3)F

InChI

InChI=1S/C16H16FN5S/c17-14-7-2-1-5-12(14)11-15-20-21-16(22(15)18)23-10-8-13-6-3-4-9-19-13/h1-7,9H,8,10-11,18H2