3-[2-(3-bromanylphenoxy)ethylsulfanyl]-5-cyclohexyl-1-phenyl-1,2,4-triazole

Systemtic Name: 3-[2-(3-bromanylphenoxy)ethylsulfanyl]-5-cyclohexyl-1-phenyl-1,2,4-triazole Openeye Name: 3-[2-(3-bromophenoxy)ethylsulfanyl]-5-cyclohexyl-1-phenyl-1,2,4-triazole CAS Name: 3-[2-(3-bromophenoxy)ethylthio]-5-cyclohexyl-1-phenyl-1,2,4-triazole IUPAC Name: 3-[2-(3-bromophenoxy)ethylsulfanyl]-5-cyclohexyl-1-phenyl-1,2,4-triazole Traditional Name: 3-[2-(3-bromophenoxy)ethylthio]-5-cyclohexyl-1-phenyl-1,2,4-triazole Formula: C22H24BrN3OS MolecularWeight: 458.41446

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NC(=NN2C3=CC=CC=C3)SCCOC4=CC(=CC=C4)Br

Isomeric SMILES

C1CCC(CC1)C2=NC(=NN2C3=CC=CC=C3)SCCOC4=CC(=CC=C4)Br

InChI

InChI=1S/C22H24BrN3OS/c23-18-10-7-13-20(16-18)27-14-15-28-22-24-21(17-8-3-1-4-9-17)26(25-22)19-11-5-2-6-12-19/h2,5-7,10-13,16-17H,1,3-4,8-9,14-15H2