6-[2-(4-oxidanylidenethieno[3,2-d]pyrimidin-3-yl)ethanoyl]-4H-1,4-benzoxazin-3-one

Systemtic Name: 6-[2-(4-oxidanylidenethieno[3,2-d]pyrimidin-3-yl)ethanoyl]-4H-1,4-benzoxazin-3-one Openeye Name: 6-[2-(4-oxothieno[3,2-d]pyrimidin-3-yl)acetyl]-4H-1,4-benzoxazin-3-one CAS Name: 6-[1-oxo-2-(4-oxo-3-thieno[3,2-d]pyrimidinyl)ethyl]-4H-1,4-benzoxazin-3-one IUPAC Name: 6-[2-(4-oxothieno[3,2-d]pyrimidin-3-yl)acetyl]-4H-1,4-benzoxazin-3-one Traditional Name: 6-[2-(4-ketothieno[3,2-d]pyrimidin-3-yl)acetyl]-4H-1,4-benzoxazin-3-one Formula: C16H11N3O4S MolecularWeight: 341.34124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(O1)C=CC(=C2)C(=O)CN3C=NC4=C(C3=O)SC=C4

Isomeric SMILES

C1C(=O)NC2=C(O1)C=CC(=C2)C(=O)CN3C=NC4=C(C3=O)SC=C4

InChI

InChI=1S/C16H11N3O4S/c20-12(6-19-8-17-10-3-4-24-15(10)16(19)22)9-1-2-13-11(5-9)18-14(21)7-23-13/h1-5,8H,6-7H2,(H,18,21)