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

Systemtic Name: 2-[[5-(2-chlorophenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[[5-(2-chlorophenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[[5-(2-chlorophenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]thio]-N-phenethylacetamide IUPAC Name: 2-[[5-(2-chlorophenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenethylacetamide Traditional Name: 2-[[5-(2-chlorophenyl)-4-cyclohexyl-1,2,4-triazol-3-yl]thio]-N-phenethyl-acetamide Formula: C24H27ClN4OS MolecularWeight: 455.01538

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=C2SCC(=O)NCCC3=CC=CC=C3)C4=CC=CC=C4Cl

Isomeric SMILES

C1CCC(CC1)N2C(=NN=C2SCC(=O)NCCC3=CC=CC=C3)C4=CC=CC=C4Cl

InChI

InChI=1S/C24H27ClN4OS/c25-21-14-8-7-13-20(21)23-27-28-24(29(23)19-11-5-2-6-12-19)31-17-22(30)26-16-15-18-9-3-1-4-10-18/h1,3-4,7-10,13-14,19H,2,5-6,11-12,15-17H2,(H,26,30)