3-(3-ethoxyphenyl)-5-[(2-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-(3-ethoxyphenyl)-5-[(2-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-(3-ethoxyphenyl)-5-[(2-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-(3-ethoxyphenyl)-5-[(2-fluorophenyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(3-ethoxyphenyl)-5-[(2-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-[(2-fluorobenzyl)thio]-5-m-phenetyl-1,2,4-triazol-4-yl]amine Formula: C17H17FN4OS MolecularWeight: 344.406483

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C2=NN=C(N2N)SCC3=CC=CC=C3F

Isomeric SMILES

CCOC1=CC=CC(=C1)C2=NN=C(N2N)SCC3=CC=CC=C3F

InChI

InChI=1S/C17H17FN4OS/c1-2-23-14-8-5-7-12(10-14)16-20-21-17(22(16)19)24-11-13-6-3-4-9-15(13)18/h3-10H,2,11,19H2,1H3