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

Systemtic Name: N-[(4-bromophenyl)methyl]-3-[(2-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: N-[(4-bromophenyl)methyl]-3-[(2-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: N-[(4-bromophenyl)methyl]-3-[(2-fluorophenyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: N-[(4-bromophenyl)methyl]-3-[(2-fluorophenyl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: (4-bromobenzyl)-[3-[(2-fluorobenzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C16H14BrFN4S MolecularWeight: 393.276563

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSC2=NN=CN2NCC3=CC=C(C=C3)Br)F

Isomeric SMILES

C1=CC=C(C(=C1)CSC2=NN=CN2NCC3=CC=C(C=C3)Br)F

InChI

InChI=1S/C16H14BrFN4S/c17-14-7-5-12(6-8-14)9-20-22-11-19-21-16(22)23-10-13-3-1-2-4-15(13)18/h1-8,11,20H,9-10H2