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

Systemtic Name: 3-[(4-bromophenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-4-amine Openeye Name: 3-[(4-bromophenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-4-amine CAS Name: 3-[(4-bromophenyl)methylthio]-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-4-amine IUPAC Name: 3-[(4-bromophenyl)methylsulfanyl]-5-[(4-methoxyphenyl)methyl]-1,2,4-triazol-4-amine Traditional Name: [3-[(4-bromobenzyl)thio]-5-p-anisyl-1,2,4-triazol-4-yl]amine Formula: C17H17BrN4OS MolecularWeight: 405.31208

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC2=NN=C(N2N)SCC3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)CC2=NN=C(N2N)SCC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H17BrN4OS/c1-23-15-8-4-12(5-9-15)10-16-20-21-17(22(16)19)24-11-13-2-6-14(18)7-3-13/h2-9H,10-11,19H2,1H3