methyl 3-[[5-[(3-iodanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-3-methyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoate

Systemtic Name: methyl 3-[[5-[(3-iodanyl-5-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-3-methyl-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoate Openeye Name: methyl 3-[[5-[(3-iodo-5-methoxy-4-prop-2-ynoxy-phenyl)methylene]-3-methyl-4-oxo-thiazolidin-2-ylidene]amino]benzoate CAS Name: 3-[[5-[(3-iodo-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-3-methyl-4-oxo-2-thiazolidinylidene]amino]benzoic acid methyl ester IUPAC Name: methyl 3-[[5-[(3-iodo-5-methoxy-4-prop-2-ynoxyphenyl)methylidene]-3-methyl-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoate Traditional Name: 3-[[5-(3-iodo-5-methoxy-4-propargyloxy-benzylidene)-4-keto-3-methyl-thiazolidin-2-ylidene]amino]benzoic acid methyl ester Formula: C23H19IN2O5S MolecularWeight: 562.37683

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C(=CC2=CC(=C(C(=C2)I)OCC#C)OC)SC1=NC3=CC=CC(=C3)C(=O)OC

Isomeric SMILES

CN1C(=O)C(=CC2=CC(=C(C(=C2)I)OCC#C)OC)SC1=NC3=CC=CC(=C3)C(=O)OC

InChI

InChI=1S/C23H19IN2O5S/c1-5-9-31-20-17(24)10-14(11-18(20)29-3)12-19-21(27)26(2)23(32-19)25-16-8-6-7-15(13-16)22(28)30-4/h1,6-8,10-13H,9H2,2-4H3