2-[(2-cyclohexylcarbonyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethylphenyl)ethanamide

Systemtic Name: 2-[(2-cyclohexylcarbonyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-ethylphenyl)ethanamide Openeye Name: 2-[[2-(cyclohexanecarbonyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-ethylphenyl)acetamide CAS Name: 2-[[2-[cyclohexyl(oxo)methyl]-5-phenyl-1,2,4-triazol-3-yl]thio]-N-(2-ethylphenyl)acetamide IUPAC Name: 2-[[2-(cyclohexanecarbonyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-ethylphenyl)acetamide Traditional Name: 2-[[2-(cyclohexanecarbonyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-N-(2-ethylphenyl)acetamide Formula: C25H28N4O2S MolecularWeight: 448.58042

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)CSC2=NC(=NN2C(=O)C3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)CSC2=NC(=NN2C(=O)C3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C25H28N4O2S/c1-2-18-11-9-10-16-21(18)26-22(30)17-32-25-27-23(19-12-5-3-6-13-19)28-29(25)24(31)20-14-7-4-8-15-20/h3,5-6,9-13,16,20H,2,4,7-8,14-15,17H2,1H3,(H,26,30)