(5E)-5-[(3-iodanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-3-(2-methoxyphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: (5E)-5-[(3-iodanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-3-(2-methoxyphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: (5E)-5-[(3-iodo-5-methoxy-4-prop-2-ynoxy-phenyl)methylene]-3-(2-methoxyphenyl)-2-thioxo-thiazolidin-4-one CAS Name: (5E)-5-[(3-iodo-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-3-(2-methoxyphenyl)-2-sulfanylidene-4-thiazolidinone IUPAC Name: (5E)-5-[(3-iodo-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-3-(2-methoxyphenyl)-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: (5E)-5-(3-iodo-5-methoxy-4-propargyloxy-benzylidene)-3-(2-methoxyphenyl)-2-thioxo-thiazolidin-4-one Formula: C21H16INO4S2 MolecularWeight: 537.39051

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=O)C(=CC3=CC(=C(C(=C3)I)OCC#C)OC)SC2=S

Isomeric SMILES

COC1=CC=CC=C1N2C(=O)/C(=C\C3=CC(=C(C(=C3)I)OCC#C)OC)/SC2=S

InChI

InChI=1S/C21H16INO4S2/c1-4-9-27-19-14(22)10-13(11-17(19)26-3)12-18-20(24)23(21(28)29-18)15-7-5-6-8-16(15)25-2/h1,5-8,10-12H,9H2,2-3H3/b18-12+