2-[[4-cyclohexyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclooctyl-ethanamide

Systemtic Name: 2-[[4-cyclohexyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclooctyl-ethanamide Openeye Name: 2-[[4-cyclohexyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclooctyl-acetamide CAS Name: 2-[[4-cyclohexyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]-N-cyclooctylacetamide IUPAC Name: 2-[[4-cyclohexyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-cyclooctylacetamide Traditional Name: 2-[[4-cyclohexyl-5-(2-fluorophenyl)-1,2,4-triazol-3-yl]thio]-N-cyclooctyl-acetamide Formula: C24H33FN4OS MolecularWeight: 444.608423

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC(=O)CSC2=NN=C(N2C3CCCCC3)C4=CC=CC=C4F

Isomeric SMILES

C1CCCC(CCC1)NC(=O)CSC2=NN=C(N2C3CCCCC3)C4=CC=CC=C4F

InChI

InChI=1S/C24H33FN4OS/c25-21-16-10-9-15-20(21)23-27-28-24(29(23)19-13-7-4-8-14-19)31-17-22(30)26-18-11-5-2-1-3-6-12-18/h9-10,15-16,18-19H,1-8,11-14,17H2,(H,26,30)