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

Systemtic Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-heptan-2-yl-ethanamide Openeye Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(1-methylhexyl)acetamide CAS Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]-N-heptan-2-ylacetamide IUPAC Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-heptan-2-ylacetamide Traditional Name: 2-[(5-cyclopentyl-1H-1,2,4-triazol-3-yl)thio]-N-(1-methylhexyl)acetamide Formula: C16H28N4OS MolecularWeight: 324.48472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)CSC1=NNC(=N1)C2CCCC2

Isomeric SMILES

CCCCCC(C)NC(=O)CSC1=NNC(=N1)C2CCCC2

InChI

InChI=1S/C16H28N4OS/c1-3-4-5-8-12(2)17-14(21)11-22-16-18-15(19-20-16)13-9-6-7-10-13/h12-13H,3-11H2,1-2H3,(H,17,21)(H,18,19,20)