S-propan-2-yl (1R,5S)-6,6-dimethylbicyclo[3.1.1]hept-3-ene-4-carbothioate

Systemtic Name: S-propan-2-yl (1R,5S)-6,6-dimethylbicyclo[3.1.1]hept-3-ene-4-carbothioate Openeye Name: S-isopropyl (1R,5S)-6,6-dimethylbicyclo[3.1.1]hept-3-ene-4-carbothioate CAS Name: (1R,5S)-6,6-dimethyl-4-bicyclo[3.1.1]hept-3-enecarbothioic acid S-propan-2-yl ester IUPAC Name: S-propan-2-yl (1R,5S)-6,6-dimethylbicyclo[3.1.1]hept-3-ene-4-carbothioate Traditional Name: (1R,5S)-6,6-dimethylbicyclo[3.1.1]hept-3-ene-4-carbothioic acid S-isopropyl ester Formula: C13H20OS MolecularWeight: 224.3623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC(=O)C1=CCC2CC1C2(C)C

Isomeric SMILES

CC(C)SC(=O)C1=CC[C@@H]2C[C@H]1C2(C)C

InChI

InChI=1S/C13H20OS/c1-8(2)15-12(14)10-6-5-9-7-11(10)13(9,3)4/h6,8-9,11H,5,7H2,1-4H3/t9-,11-/m1/s1