[(1S)-1-cyanoethyl] thieno[3,2-b][1]benzothiole-2-carboxylate

Systemtic Name: [(1S)-1-cyanoethyl] thieno[3,2-b][1]benzothiole-2-carboxylate Openeye Name: [(1S)-1-cyanoethyl] thieno[3,2-b]benzothiophene-2-carboxylate CAS Name: 2-thieno[3,2-b][1]benzothiolecarboxylic acid [(1S)-1-cyanoethyl] ester IUPAC Name: [(1S)-1-cyanoethyl] thieno[3,2-b][1]benzothiole-2-carboxylate Traditional Name: thieno[3,2-b]benzothiophene-2-carboxylic acid [(1S)-1-cyanoethyl] ester Formula: C14H9NO2S2 MolecularWeight: 287.35676

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC(=O)C1=CC2=C(S1)C3=CC=CC=C3S2

Isomeric SMILES

C[C@@H](C#N)OC(=O)C1=CC2=C(S1)C3=CC=CC=C3S2

InChI

InChI=1S/C14H9NO2S2/c1-8(7-15)17-14(16)12-6-11-13(19-12)9-4-2-3-5-10(9)18-11/h2-6,8H,1H3/t8-/m0/s1