3-[2-(2-fluoranylphenoxy)ethylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-amine

Systemtic Name: 3-[2-(2-fluoranylphenoxy)ethylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-amine Openeye Name: 3-[2-(2-fluorophenoxy)ethylsulfanyl]-5-(2-thienyl)-1,2,4-triazol-4-amine CAS Name: 3-[2-(2-fluorophenoxy)ethylthio]-5-thiophen-2-yl-1,2,4-triazol-4-amine IUPAC Name: 3-[2-(2-fluorophenoxy)ethylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-amine Traditional Name: [3-[2-(2-fluorophenoxy)ethylthio]-5-(2-thienyl)-1,2,4-triazol-4-yl]amine Formula: C14H13FN4OS2 MolecularWeight: 336.407623

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OCCSC2=NN=C(N2N)C3=CC=CS3)F

Isomeric SMILES

C1=CC=C(C(=C1)OCCSC2=NN=C(N2N)C3=CC=CS3)F

InChI

InChI=1S/C14H13FN4OS2/c15-10-4-1-2-5-11(10)20-7-9-22-14-18-17-13(19(14)16)12-6-3-8-21-12/h1-6,8H,7,9,16H2