S-thiophen-2-yl (1R,4S,5S)-bicyclo[2.2.2]oct-2-ene-5-carbothioate

Systemtic Name: S-thiophen-2-yl (1R,4S,5S)-bicyclo[2.2.2]oct-2-ene-5-carbothioate Openeye Name: S-(2-thienyl) (1R,4S,5S)-bicyclo[2.2.2]oct-2-ene-5-carbothioate CAS Name: (1R,4S,5S)-5-bicyclo[2.2.2]oct-2-enecarbothioic acid S-thiophen-2-yl ester IUPAC Name: S-thiophen-2-yl (1R,4S,5S)-bicyclo[2.2.2]oct-2-ene-5-carbothioate Traditional Name: (1R,4S,5S)-bicyclo[2.2.2]oct-2-ene-5-carbothioic acid S-(2-thienyl) ester Formula: C13H14OS2 MolecularWeight: 250.37966

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C=CC1CC2C(=O)SC3=CC=CS3

Isomeric SMILES

C1C[C@H]2C=C[C@H]1C[C@@H]2C(=O)SC3=CC=CS3

InChI

InChI=1S/C13H14OS2/c14-13(16-12-2-1-7-15-12)11-8-9-3-5-10(11)6-4-9/h1-3,5,7,9-11H,4,6,8H2/t9-,10-,11+/m1/s1