N-isoquinolin-5-yl-3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanamide

Systemtic Name: N-isoquinolin-5-yl-3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanamide Openeye Name: N-(5-isoquinolyl)-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide CAS Name: N-(5-isoquinolinyl)-3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propanamide IUPAC Name: N-isoquinolin-5-yl-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide Traditional Name: N-(5-isoquinolyl)-3-(4-ketothieno[2,3-d]pyrimidin-3-yl)propionamide Formula: C18H14N4O2S MolecularWeight: 350.39436

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CN=C2)C(=C1)NC(=O)CCN3C=NC4=C(C3=O)C=CS4

Isomeric SMILES

C1=CC2=C(C=CN=C2)C(=C1)NC(=O)CCN3C=NC4=C(C3=O)C=CS4

InChI

InChI=1S/C18H14N4O2S/c23-16(21-15-3-1-2-12-10-19-7-4-13(12)15)5-8-22-11-20-17-14(18(22)24)6-9-25-17/h1-4,6-7,9-11H,5,8H2,(H,21,23)