N-[5-[(3-iodanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]ethanamide

Systemtic Name: N-[5-[(3-iodanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-4-oxidanylidene-1,3-thiazol-2-yl]ethanamide Openeye Name: N-[5-[(3-iodo-5-methoxy-4-prop-2-ynoxy-phenyl)methylene]-4-oxo-thiazol-2-yl]acetamide CAS Name: N-[5-[(3-iodo-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-4-oxo-2-thiazolyl]acetamide IUPAC Name: N-[5-[(3-iodo-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-4-oxo-1,3-thiazol-2-yl]acetamide Traditional Name: N-[5-(3-iodo-5-methoxy-4-propargyloxy-benzylidene)-4-keto-2-thiazolin-2-yl]acetamide Formula: C16H13IN2O4S MolecularWeight: 456.25489

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=O)C(=CC2=CC(=C(C(=C2)I)OCC#C)OC)S1

Isomeric SMILES

CC(=O)NC1=NC(=O)C(=CC2=CC(=C(C(=C2)I)OCC#C)OC)S1

InChI

InChI=1S/C16H13IN2O4S/c1-4-5-23-14-11(17)6-10(7-12(14)22-3)8-13-15(21)19-16(24-13)18-9(2)20/h1,6-8H,5H2,2-3H3,(H,18,19,20,21)