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

Systemtic Name: 3-[(3-bromophenyl)methylsulfanyl]-5-(3-fluorophenyl)-1,2,4-triazol-4-amine Openeye Name: 3-[(3-bromophenyl)methylsulfanyl]-5-(3-fluorophenyl)-1,2,4-triazol-4-amine CAS Name: 3-[(3-bromophenyl)methylthio]-5-(3-fluorophenyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[(3-bromophenyl)methylsulfanyl]-5-(3-fluorophenyl)-1,2,4-triazol-4-amine Traditional Name: [3-[(3-bromobenzyl)thio]-5-(3-fluorophenyl)-1,2,4-triazol-4-yl]amine Formula: C15H12BrFN4S MolecularWeight: 379.249983

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)CSC2=NN=C(N2N)C3=CC(=CC=C3)F

Isomeric SMILES

C1=CC(=CC(=C1)Br)CSC2=NN=C(N2N)C3=CC(=CC=C3)F

InChI

InChI=1S/C15H12BrFN4S/c16-12-5-1-3-10(7-12)9-22-15-20-19-14(21(15)18)11-4-2-6-13(17)8-11/h1-8H,9,18H2