3-cyano-2-(3-phenylbutanoylamino)-N-(2-pyridin-4-ylethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxamide

Systemtic Name: 3-cyano-2-(3-phenylbutanoylamino)-N-(2-pyridin-4-ylethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxamide Openeye Name: 3-cyano-2-(3-phenylbutanoylamino)-N-[2-(4-pyridyl)ethyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxamide CAS Name: 3-cyano-2-[(1-oxo-3-phenylbutyl)amino]-N-(2-pyridin-4-ylethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxamide IUPAC Name: 3-cyano-2-(3-phenylbutanoylamino)-N-(2-pyridin-4-ylethyl)-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxamide Traditional Name: 3-cyano-2-(3-phenylbutanoylamino)-N-[2-(4-pyridyl)ethyl]-5,7-dihydro-4H-thieno[2,3-c]pyridine-6-carboxamide Formula: C26H27N5O2S MolecularWeight: 473.58988

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)NC1=C(C2=C(S1)CN(CC2)C(=O)NCCC3=CC=NC=C3)C#N)C4=CC=CC=C4

Isomeric SMILES

CC(CC(=O)NC1=C(C2=C(S1)CN(CC2)C(=O)NCCC3=CC=NC=C3)C#N)C4=CC=CC=C4

InChI

InChI=1S/C26H27N5O2S/c1-18(20-5-3-2-4-6-20)15-24(32)30-25-22(16-27)21-10-14-31(17-23(21)34-25)26(33)29-13-9-19-7-11-28-12-8-19/h2-8,11-12,18H,9-10,13-15,17H2,1H3,(H,29,33)(H,30,32)