3-[(2-fluoranylphenoxy)methyl]-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[(2-fluoranylphenoxy)methyl]-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-4-amine Openeye Name: 3-[(2-fluorophenoxy)methyl]-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-4-amine CAS Name: 3-[(2-fluorophenoxy)methyl]-5-(2-phenoxyethylthio)-1,2,4-triazol-4-amine IUPAC Name: 3-[(2-fluorophenoxy)methyl]-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-4-amine Traditional Name: [3-[(2-fluorophenoxy)methyl]-5-(2-phenoxyethylthio)-1,2,4-triazol-4-yl]amine Formula: C17H17FN4O2S MolecularWeight: 360.405883

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCSC2=NN=C(N2N)COC3=CC=CC=C3F

Isomeric SMILES

C1=CC=C(C=C1)OCCSC2=NN=C(N2N)COC3=CC=CC=C3F

InChI

InChI=1S/C17H17FN4O2S/c18-14-8-4-5-9-15(14)24-12-16-20-21-17(22(16)19)25-11-10-23-13-6-2-1-3-7-13/h1-9H,10-12,19H2