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

Systemtic Name: 3-(4-ethoxyphenyl)-5-[(3-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-(4-ethoxyphenyl)-5-[(3-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-(4-ethoxyphenyl)-5-[(3-fluorophenyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(4-ethoxyphenyl)-5-[(3-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-[(3-fluorobenzyl)thio]-5-p-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=C(C=C1)C2=NN=C(N2N)SCC3=CC(=CC=C3)F

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NN=C(N2N)SCC3=CC(=CC=C3)F

InChI

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