S-(2,2,5,5-tetramethyl-1-prop-2-enoxy-imidazol-4-yl) 2-ethylhexanethioate

Systemtic Name: S-(2,2,5,5-tetramethyl-1-prop-2-enoxy-imidazol-4-yl) 2-ethylhexanethioate Openeye Name: S-(1-allyloxy-2,2,5,5-tetramethyl-imidazol-4-yl) 2-ethylhexanethioate CAS Name: 2-ethylhexanethioic acid S-(2,2,5,5-tetramethyl-1-prop-2-enoxy-4-imidazolyl) ester IUPAC Name: S-(2,2,5,5-tetramethyl-1-prop-2-enoxyimidazol-4-yl) 2-ethylhexanethioate Traditional Name: 2-ethylhexanethioic acid S-(1-allyloxy-2,2,5,5-tetramethyl-3-imidazolin-4-yl) ester Formula: C18H32N2O2S MolecularWeight: 340.52388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)SC1=NC(N(C1(C)C)OCC=C)(C)C

Isomeric SMILES

CCCCC(CC)C(=O)SC1=NC(N(C1(C)C)OCC=C)(C)C

InChI

InChI=1S/C18H32N2O2S/c1-8-11-12-14(10-3)15(21)23-16-17(4,5)20(22-13-9-2)18(6,7)19-16/h9,14H,2,8,10-13H2,1,3-7H3