2-methoxyethyl 3-cyano-2-(3-pyridin-3-ylpropanoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate

Systemtic Name: 2-methoxyethyl 3-cyano-2-(3-pyridin-3-ylpropanoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: 2-methoxyethyl 3-cyano-2-[3-(3-pyridyl)propanoylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 3-cyano-2-[[1-oxo-3-(3-pyridinyl)propyl]amino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 3-cyano-2-(3-pyridin-3-ylpropanoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 3-cyano-2-[3-(3-pyridyl)propanoylamino]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid 2-methoxyethyl ester Formula: C20H22N4O4S MolecularWeight: 414.47808

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC(=O)N1CCC2=C(C1)SC(=C2C#N)NC(=O)CCC3=CN=CC=C3

Isomeric SMILES

COCCOC(=O)N1CCC2=C(C1)SC(=C2C#N)NC(=O)CCC3=CN=CC=C3

InChI

InChI=1S/C20H22N4O4S/c1-27-9-10-28-20(26)24-8-6-15-16(11-21)19(29-17(15)13-24)23-18(25)5-4-14-3-2-7-22-12-14/h2-3,7,12H,4-6,8-10,13H2,1H3,(H,23,25)