(6Z)-7-oxidanyl-6-[(2-sulfanylidene-1H-pyrimidin-5-yl)methylidene]-1,3-benzodioxol-5-one

Systemtic Name: (6Z)-7-oxidanyl-6-[(2-sulfanylidene-1H-pyrimidin-5-yl)methylidene]-1,3-benzodioxol-5-one Openeye Name: (6Z)-7-hydroxy-6-[(2-thioxo-1H-pyrimidin-5-yl)methylene]-1,3-benzodioxol-5-one CAS Name: (6Z)-7-hydroxy-6-[(2-sulfanylidene-1H-pyrimidin-5-yl)methylidene]-1,3-benzodioxol-5-one IUPAC Name: (6Z)-7-hydroxy-6-[(2-sulfanylidene-1H-pyrimidin-5-yl)methylidene]-1,3-benzodioxol-5-one Traditional Name: (6Z)-7-hydroxy-6-[(2-thioxo-1H-pyrimidin-5-yl)methylene]-1,3-benzodioxol-5-one Formula: C12H8N2O4S MolecularWeight: 276.26792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=CC(=O)C(=CC3=CNC(=S)N=C3)C(=C2O1)O

Isomeric SMILES

C1OC2=CC(=O)/C(=C\C3=CNC(=S)N=C3)/C(=C2O1)O

InChI

InChI=1S/C12H8N2O4S/c15-8-2-9-11(18-5-17-9)10(16)7(8)1-6-3-13-12(19)14-4-6/h1-4,16H,5H2,(H,13,14,19)/b7-1+