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

Systemtic Name: N-[(5Z)-5-[(6-bromanyl-1,3-benzodioxol-5-yl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]propanamide Openeye Name: N-[(5Z)-5-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-4-oxo-thiazol-2-yl]propanamide CAS Name: N-[(5Z)-5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-4-oxo-2-thiazolyl]propanamide IUPAC Name: N-[(5Z)-5-[(6-bromo-1,3-benzodioxol-5-yl)methylidene]-4-oxo-1,3-thiazol-2-yl]propanamide Traditional Name: N-[(5Z)-5-[(6-bromo-1,3-benzodioxol-5-yl)methylene]-4-keto-2-thiazolin-2-yl]propionamide Formula: C14H11BrN2O4S MolecularWeight: 383.21714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11BrN2O4S/c1-2-12(18)16-14-17-13(19)11(22-14)4-7-3-9-10(5-8(7)15)21-6-20-9/h3-5H,2,6H2,1H3,(H,16,17,18,19)/b11-4-