ethyl (1S,2S,6R,7S)-2-azanyl-2-cyano-5-thiabicyclo[4.1.0]heptane-7-carboxylate

Systemtic Name: ethyl (1S,2S,6R,7S)-2-azanyl-2-cyano-5-thiabicyclo[4.1.0]heptane-7-carboxylate Openeye Name: ethyl (1S,2S,6R,7S)-2-amino-2-cyano-5-thiabicyclo[4.1.0]heptane-7-carboxylate CAS Name: (1S,2S,6R,7S)-2-amino-2-cyano-5-thiabicyclo[4.1.0]heptane-7-carboxylic acid ethyl ester IUPAC Name: ethyl (1S,2S,6R,7S)-2-amino-2-cyano-5-thiabicyclo[4.1.0]heptane-7-carboxylate Traditional Name: (1S,2S,6R,7S)-2-amino-2-cyano-5-thiabicyclo[4.1.0]heptane-7-carboxylic acid ethyl ester Formula: C10H14N2O2S MolecularWeight: 226.29536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C2C1SCCC2(C#N)N

Isomeric SMILES

CCOC(=O)[C@@H]1[C@@H]2[C@H]1SCC[C@]2(C#N)N

InChI

InChI=1S/C10H14N2O2S/c1-2-14-9(13)6-7-8(6)15-4-3-10(7,12)5-11/h6-8H,2-4,12H2,1H3/t6-,7-,8+,10-/m1/s1