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

Systemtic Name: 3-[2-(4-bromanylphenoxy)ethylsulfanyl]-5-cyclohexyl-1,2,4-triazol-4-amine Openeye Name: 3-[2-(4-bromophenoxy)ethylsulfanyl]-5-cyclohexyl-1,2,4-triazol-4-amine CAS Name: 3-[2-(4-bromophenoxy)ethylthio]-5-cyclohexyl-1,2,4-triazol-4-amine IUPAC Name: 3-[2-(4-bromophenoxy)ethylsulfanyl]-5-cyclohexyl-1,2,4-triazol-4-amine Traditional Name: [3-[2-(4-bromophenoxy)ethylthio]-5-cyclohexyl-1,2,4-triazol-4-yl]amine Formula: C16H21BrN4OS MolecularWeight: 397.33314

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN=C(N2N)SCCOC3=CC=C(C=C3)Br

Isomeric SMILES

C1CCC(CC1)C2=NN=C(N2N)SCCOC3=CC=C(C=C3)Br

InChI

InChI=1S/C16H21BrN4OS/c17-13-6-8-14(9-7-13)22-10-11-23-16-20-19-15(21(16)18)12-4-2-1-3-5-12/h6-9,12H,1-5,10-11,18H2