N-[(5E)-5-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]ethanamide

Systemtic Name: N-[(5E)-5-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]ethanamide Openeye Name: N-[(5E)-5-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-4-oxo-thiazol-2-yl]acetamide CAS Name: N-[(5E)-5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-thiazolyl]acetamide IUPAC Name: N-[(5E)-5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-4-oxo-1,3-thiazol-2-yl]acetamide Traditional Name: N-[(5E)-5-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-4-keto-2-thiazolin-2-yl]acetamide Formula: C13H9BrN2O4S MolecularWeight: 369.19056

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=O)C(=CC2=CC3=C(C=C2Br)OCO3)S1

Isomeric SMILES

CC(=O)NC1=NC(=O)/C(=C\C2=CC3=C(C=C2Br)OCO3)/S1

InChI

InChI=1S/C13H9BrN2O4S/c1-6(17)15-13-16-12(18)11(21-13)3-7-2-9-10(4-8(7)14)20-5-19-9/h2-4H,5H2,1H3,(H,15,16,17,18)/b11-3+