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

Systemtic Name: 2-morpholin-4-ylethyl 3-cyano-2-(3-pyridin-3-ylpropanoylamino)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: 2-morpholinoethyl 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-(4-morpholinyl)ethyl ester IUPAC Name: 2-morpholin-4-ylethyl 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-morpholinoethyl ester Formula: C23H27N5O4S MolecularWeight: 469.55658

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C(=C(S2)NC(=O)CCC3=CN=CC=C3)C#N)C(=O)OCCN4CCOCC4

Isomeric SMILES

C1CN(CC2=C1C(=C(S2)NC(=O)CCC3=CN=CC=C3)C#N)C(=O)OCCN4CCOCC4

InChI

InChI=1S/C23H27N5O4S/c24-14-19-18-5-7-28(23(30)32-13-10-27-8-11-31-12-9-27)16-20(18)33-22(19)26-21(29)4-3-17-2-1-6-25-15-17/h1-2,6,15H,3-5,7-13,16H2,(H,26,29)