3-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-5-(3-fluorophenyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[(4-bromanyl-2-fluoranyl-phenyl)methylsulfanyl]-5-(3-fluorophenyl)-1,2,4-triazol-4-amine Openeye Name: 3-[(4-bromo-2-fluoro-phenyl)methylsulfanyl]-5-(3-fluorophenyl)-1,2,4-triazol-4-amine CAS Name: 3-[(4-bromo-2-fluorophenyl)methylthio]-5-(3-fluorophenyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[(4-bromo-2-fluorophenyl)methylsulfanyl]-5-(3-fluorophenyl)-1,2,4-triazol-4-amine Traditional Name: [3-[(4-bromo-2-fluoro-benzyl)thio]-5-(3-fluorophenyl)-1,2,4-triazol-4-yl]amine Formula: C15H11BrF2N4S MolecularWeight: 397.240446

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H11BrF2N4S/c16-11-5-4-10(13(18)7-11)8-23-15-21-20-14(22(15)19)9-2-1-3-12(17)6-9/h1-7H,8,19H2