2-piperidin-1-ylethyl 2-benzamido-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate

Systemtic Name: 2-piperidin-1-ylethyl 2-benzamido-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Openeye Name: 2-(1-piperidyl)ethyl 2-benzamido-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate CAS Name: 2-benzamido-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid 2-(1-piperidinyl)ethyl ester IUPAC Name: 2-piperidin-1-ylethyl 2-benzamido-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylate Traditional Name: 2-benzamido-3-cyano-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxylic acid 2-piperidinoethyl ester Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOC(=O)N2CCC3=C(C2)SC(=C3C#N)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)CCOC(=O)N2CCC3=C(C2)SC(=C3C#N)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H26N4O3S/c24-15-19-18-9-12-27(23(29)30-14-13-26-10-5-2-6-11-26)16-20(18)31-22(19)25-21(28)17-7-3-1-4-8-17/h1,3-4,7-8H,2,5-6,9-14,16H2,(H,25,28)