[2-[(2-cyano-1-benzofuran-3-yl)amino]-2-oxidanylidene-ethyl] thieno[3,2-b][1]benzothiole-2-carboxylate

Systemtic Name: [2-[(2-cyano-1-benzofuran-3-yl)amino]-2-oxidanylidene-ethyl] thieno[3,2-b][1]benzothiole-2-carboxylate Openeye Name: [2-[(2-cyanobenzofuran-3-yl)amino]-2-oxo-ethyl] thieno[3,2-b]benzothiophene-2-carboxylate CAS Name: 2-thieno[3,2-b][1]benzothiolecarboxylic acid [2-[(2-cyano-3-benzofuranyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(2-cyano-1-benzofuran-3-yl)amino]-2-oxoethyl] thieno[3,2-b][1]benzothiole-2-carboxylate Traditional Name: thieno[3,2-b]benzothiophene-2-carboxylic acid [2-[(2-cyanobenzofuran-3-yl)amino]-2-keto-ethyl] ester Formula: C22H12N2O4S2 MolecularWeight: 432.47168

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C(O2)C#N)NC(=O)COC(=O)C3=CC4=C(S3)C5=CC=CC=C5S4

Isomeric SMILES

C1=CC=C2C(=C1)C(=C(O2)C#N)NC(=O)COC(=O)C3=CC4=C(S3)C5=CC=CC=C5S4

InChI

InChI=1S/C22H12N2O4S2/c23-10-15-20(12-5-1-3-7-14(12)28-15)24-19(25)11-27-22(26)18-9-17-21(30-18)13-6-2-4-8-16(13)29-17/h1-9H,11H2,(H,24,25)