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

Systemtic Name: N-(1-adamantyl)-2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(1-adamantyl)-2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(1-adamantyl)-2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(1-adamantyl)-2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(1-adamantyl)-2-[[5-(2-cyclopentylethyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C21H32N4OS MolecularWeight: 388.56998

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)CCC2=NC(=NN2)SCC(=O)NC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CCC(C1)CCC2=NC(=NN2)SCC(=O)NC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H32N4OS/c26-19(23-21-10-15-7-16(11-21)9-17(8-15)12-21)13-27-20-22-18(24-25-20)6-5-14-3-1-2-4-14/h14-17H,1-13H2,(H,23,26)(H,22,24,25)