3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)propanamide

Systemtic Name: 3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)propanamide Openeye Name: 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)propanamide CAS Name: 3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)-N-[3-(1-pyrrolidinyl)-2-quinoxalinyl]propanamide IUPAC Name: 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)propanamide Traditional Name: 3-(4-ketothieno[2,3-d]pyrimidin-3-yl)-N-(3-pyrrolidinoquinoxalin-2-yl)propionamide Formula: C21H20N6O2S MolecularWeight: 420.4875

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC3=CC=CC=C3N=C2NC(=O)CCN4C=NC5=C(C4=O)C=CS5

Isomeric SMILES

C1CCN(C1)C2=NC3=CC=CC=C3N=C2NC(=O)CCN4C=NC5=C(C4=O)C=CS5

InChI

InChI=1S/C21H20N6O2S/c28-17(7-11-27-13-22-20-14(21(27)29)8-12-30-20)25-18-19(26-9-3-4-10-26)24-16-6-2-1-5-15(16)23-18/h1-2,5-6,8,12-13H,3-4,7,9-11H2,(H,23,25,28)