ethyl 4-oxidanylidene-3-sulfanyl-6,7-dihydro-5H-2-benzothiophene-1-carboxylate

Systemtic Name: ethyl 4-oxidanylidene-3-sulfanyl-6,7-dihydro-5H-2-benzothiophene-1-carboxylate Openeye Name: ethyl 4-oxo-3-sulfanyl-6,7-dihydro-5H-2-benzothiophene-1-carboxylate CAS Name: 3-mercapto-4-oxo-6,7-dihydro-5H-2-benzothiophene-1-carboxylic acid ethyl ester IUPAC Name: ethyl 4-oxo-3-sulfanyl-6,7-dihydro-5H-2-benzothiophene-1-carboxylate Traditional Name: 4-keto-3-mercapto-6,7-dihydro-5H-isobenzothiophene-1-carboxylic acid ethyl ester Formula: C11H12O3S2 MolecularWeight: 256.34118

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2CCCC(=O)C2=C(S1)S

Isomeric SMILES

CCOC(=O)C1=C2CCCC(=O)C2=C(S1)S

InChI

InChI=1S/C11H12O3S2/c1-2-14-10(13)9-6-4-3-5-7(12)8(6)11(15)16-9/h15H,2-5H2,1H3