N-(1-adamantyl)-2-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(1-adamantyl)-2-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(1-adamantyl)-2-[[4-cyclohexyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(1-adamantyl)-2-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(1-adamantyl)-2-[[4-cyclohexyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(1-adamantyl)-2-[[4-cyclohexyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C25H34N4OS2 MolecularWeight: 470.69366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=NN=C2SCC(=O)NC34CC5CC(C3)CC(C5)C4)CC6=CC=CS6

Isomeric SMILES

C1CCC(CC1)N2C(=NN=C2SCC(=O)NC34CC5CC(C3)CC(C5)C4)CC6=CC=CS6

InChI

InChI=1S/C25H34N4OS2/c30-23(26-25-13-17-9-18(14-25)11-19(10-17)15-25)16-32-24-28-27-22(12-21-7-4-8-31-21)29(24)20-5-2-1-3-6-20/h4,7-8,17-20H,1-3,5-6,9-16H2,(H,26,30)