O-ethyl (1S,2R,5S)-3,3-bis(chloranyl)-5-cyano-2-methyl-cyclopentane-1-carbothioate

Systemtic Name: O-ethyl (1S,2R,5S)-3,3-bis(chloranyl)-5-cyano-2-methyl-cyclopentane-1-carbothioate Openeye Name: O-ethyl (1S,2R,5S)-3,3-dichloro-5-cyano-2-methyl-cyclopentanecarbothioate CAS Name: (1S,2R,5S)-3,3-dichloro-5-cyano-2-methyl-1-cyclopentanecarbothioic acid O-ethyl ester IUPAC Name: O-ethyl (1S,2R,5S)-3,3-dichloro-5-cyano-2-methylcyclopentane-1-carbothioate Traditional Name: (1S,2R,5S)-3,3-dichloro-5-cyano-2-methyl-cyclopentanecarbothioic acid O-ethyl ester Formula: C10H13Cl2NOS MolecularWeight: 266.18732

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)C1C(C(CC1C#N)(Cl)Cl)C

Isomeric SMILES

CCOC(=S)[C@@H]1[C@H](C(C[C@@H]1C#N)(Cl)Cl)C

InChI

InChI=1S/C10H13Cl2NOS/c1-3-14-9(15)8-6(2)10(11,12)4-7(8)5-13/h6-8H,3-4H2,1-2H3/t6-,7-,8-/m1/s1