3-(2-bromophenyl)-5-[3-(4-fluoranylphenoxy)propylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-(2-bromophenyl)-5-[3-(4-fluoranylphenoxy)propylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-(2-bromophenyl)-5-[3-(4-fluorophenoxy)propylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-(2-bromophenyl)-5-[3-(4-fluorophenoxy)propylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(2-bromophenyl)-5-[3-(4-fluorophenoxy)propylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-(2-bromophenyl)-5-[3-(4-fluorophenoxy)propylthio]-1,2,4-triazol-4-yl]amine Formula: C17H16BrFN4OS MolecularWeight: 423.302543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=NN=C(N2N)SCCCOC3=CC=C(C=C3)F)Br

Isomeric SMILES

C1=CC=C(C(=C1)C2=NN=C(N2N)SCCCOC3=CC=C(C=C3)F)Br

InChI

InChI=1S/C17H16BrFN4OS/c18-15-5-2-1-4-14(15)16-21-22-17(23(16)20)25-11-3-10-24-13-8-6-12(19)7-9-13/h1-2,4-9H,3,10-11,20H2