2-[(4-cyclooctyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]ethanoate

Systemtic Name: 2-[(4-cyclooctyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]ethanoate Openeye Name: 2-[(4-cyclooctyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]acetate CAS Name: 2-[(4-cyclooctyl-5-propyl-1,2,4-triazol-3-yl)thio]acetate IUPAC Name: 2-[(4-cyclooctyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]acetate Traditional Name: 2-[(4-cyclooctyl-5-propyl-1,2,4-triazol-3-yl)thio]acetate Formula: C15H24N3O2S- MolecularWeight: 310.43496

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1C2CCCCCCC2)SCC(=O)[O-]

Isomeric SMILES

CCCC1=NN=C(N1C2CCCCCCC2)SCC(=O)[O-]

InChI

InChI=1S/C15H25N3O2S/c1-2-8-13-16-17-15(21-11-14(19)20)18(13)12-9-6-4-3-5-7-10-12/h12H,2-11H2,1H3,(H,19,20)/p-1