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

Systemtic Name: 3-[2-(3-bromanylphenoxy)ethylsulfanyl]-5-cyclohexyl-1,2,4-triazol-4-amine Openeye Name: 3-[2-(3-bromophenoxy)ethylsulfanyl]-5-cyclohexyl-1,2,4-triazol-4-amine CAS Name: 3-[2-(3-bromophenoxy)ethylthio]-5-cyclohexyl-1,2,4-triazol-4-amine IUPAC Name: 3-[2-(3-bromophenoxy)ethylsulfanyl]-5-cyclohexyl-1,2,4-triazol-4-amine Traditional Name: [3-[2-(3-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(=CC=C3)Br

Isomeric SMILES

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

InChI

InChI=1S/C16H21BrN4OS/c17-13-7-4-8-14(11-13)22-9-10-23-16-20-19-15(21(16)18)12-5-2-1-3-6-12/h4,7-8,11-12H,1-3,5-6,9-10,18H2