2-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)-N-(5-piperidin-1-ylisoquinolin-8-yl)ethanamide

Systemtic Name: 2-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)-N-(5-piperidin-1-ylisoquinolin-8-yl)ethanamide Openeye Name: 2-(4-oxothieno[2,3-d]pyrimidin-3-yl)-N-[5-(1-piperidyl)-8-isoquinolyl]acetamide CAS Name: 2-(4-oxo-3-thieno[2,3-d]pyrimidinyl)-N-[5-(1-piperidinyl)-8-isoquinolinyl]acetamide IUPAC Name: 2-(4-oxothieno[2,3-d]pyrimidin-3-yl)-N-(5-piperidin-1-ylisoquinolin-8-yl)acetamide Traditional Name: 2-(4-ketothieno[2,3-d]pyrimidin-3-yl)-N-(5-piperidino-8-isoquinolyl)acetamide Formula: C22H21N5O2S MolecularWeight: 419.49944

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)CN4C=NC5=C(C4=O)C=CS5

Isomeric SMILES

C1CCN(CC1)C2=C3C=CN=CC3=C(C=C2)NC(=O)CN4C=NC5=C(C4=O)C=CS5

InChI

InChI=1S/C22H21N5O2S/c28-20(13-27-14-24-21-16(22(27)29)7-11-30-21)25-18-4-5-19(26-9-2-1-3-10-26)15-6-8-23-12-17(15)18/h4-8,11-12,14H,1-3,9-10,13H2,(H,25,28)