N-(1-adamantyl)-2-[[5-(oxolan-2-yl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(1-adamantyl)-2-[[5-(oxolan-2-yl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(1-adamantyl)-2-[(5-tetrahydrofuran-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(1-adamantyl)-2-[[5-(2-oxolanyl)-1H-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(1-adamantyl)-2-[[5-(oxolan-2-yl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(1-adamantyl)-2-[[5-(tetrahydrofuryl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C18H26N4O2S MolecularWeight: 362.48964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)C2=NC(=NN2)SCC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CC(OC1)C2=NC(=NN2)SCC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C18H26N4O2S/c23-15(10-25-17-19-16(21-22-17)14-2-1-3-24-14)20-18-7-11-4-12(8-18)6-13(5-11)9-18/h11-14H,1-10H2,(H,20,23)(H,19,21,22)