3-[2-(4-bromanylphenoxy)ethylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[2-(4-bromanylphenoxy)ethylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine Openeye Name: 3-[2-(4-bromophenoxy)ethylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine CAS Name: 3-[2-(4-bromophenoxy)ethylthio]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[2-(4-bromophenoxy)ethylsulfanyl]-5-(4-methoxyphenyl)-1,2,4-triazol-4-amine Traditional Name: [3-[2-(4-bromophenoxy)ethylthio]-5-(4-methoxyphenyl)-1,2,4-triazol-4-yl]amine Formula: C17H17BrN4O2S MolecularWeight: 421.31148

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(N2N)SCCOC3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(N2N)SCCOC3=CC=C(C=C3)Br

InChI

InChI=1S/C17H17BrN4O2S/c1-23-14-6-2-12(3-7-14)16-20-21-17(22(16)19)25-11-10-24-15-8-4-13(18)5-9-15/h2-9H,10-11,19H2,1H3