N-cyclohexyl-2-[[4-ethyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide

Systemtic Name: N-cyclohexyl-2-[[4-ethyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-ethanamide Openeye Name: N-cyclohexyl-2-[[4-ethyl-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-acetamide CAS Name: N-cyclohexyl-2-[[4-ethyl-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]-N-phenylacetamide IUPAC Name: N-cyclohexyl-2-[[4-ethyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenylacetamide Traditional Name: N-cyclohexyl-2-[[4-ethyl-5-(2-furyl)-1,2,4-triazol-3-yl]thio]-N-phenyl-acetamide Formula: C22H26N4O2S MolecularWeight: 410.53244

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)N(C2CCCCC2)C3=CC=CC=C3)C4=CC=CO4

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)N(C2CCCCC2)C3=CC=CC=C3)C4=CC=CO4

InChI

InChI=1S/C22H26N4O2S/c1-2-25-21(19-14-9-15-28-19)23-24-22(25)29-16-20(27)26(17-10-5-3-6-11-17)18-12-7-4-8-13-18/h3,5-6,9-11,14-15,18H,2,4,7-8,12-13,16H2,1H3