ethyl 3-cyano-2-[(7-ethoxy-1-benzofuran-2-yl)carbonylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate

Systemtic Name: ethyl 3-cyano-2-[(7-ethoxy-1-benzofuran-2-yl)carbonylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: ethyl 3-cyano-2-[(7-ethoxybenzofuran-2-carbonyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 3-cyano-2-[[(7-ethoxy-2-benzofuranyl)-oxomethyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-2-[(7-ethoxy-1-benzofuran-2-carbonyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 3-cyano-2-[(7-ethoxybenzofuran-2-carbonyl)amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid ethyl ester Formula: C22H21N3O5S MolecularWeight: 439.48424

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1OC(=C2)C(=O)NC3=C(C4=C(S3)CN(CC4)C(=O)OCC)C#N

Isomeric SMILES

CCOC1=CC=CC2=C1OC(=C2)C(=O)NC3=C(C4=C(S3)CN(CC4)C(=O)OCC)C#N

InChI

InChI=1S/C22H21N3O5S/c1-3-28-16-7-5-6-13-10-17(30-19(13)16)20(26)24-21-15(11-23)14-8-9-25(12-18(14)31-21)22(27)29-4-2/h5-7,10H,3-4,8-9,12H2,1-2H3,(H,24,26)