3-(1,3-benzodioxol-5-yl)-5-[(3-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-5-[(3-methoxy-4-prop-2-ynoxy-phenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-5-[(3-methoxy-4-prop-2-ynoxy-phenyl)methylene]-2-thioxo-thiazolidin-4-one CAS Name: 3-(1,3-benzodioxol-5-yl)-5-[(3-methoxy-4-prop-2-ynoxyphenyl)methylidene]-2-sulfanylidene-4-thiazolidinone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-5-[(3-methoxy-4-prop-2-ynoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-5-(3-methoxy-4-propargyloxy-benzylidene)-2-thioxo-thiazolidin-4-one Formula: C21H15NO5S2 MolecularWeight: 425.4775

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)C3=CC4=C(C=C3)OCO4)OCC#C

Isomeric SMILES

COC1=C(C=CC(=C1)C=C2C(=O)N(C(=S)S2)C3=CC4=C(C=C3)OCO4)OCC#C

InChI

InChI=1S/C21H15NO5S2/c1-3-8-25-15-6-4-13(9-17(15)24-2)10-19-20(23)22(21(28)29-19)14-5-7-16-18(11-14)27-12-26-16/h1,4-7,9-11H,8,12H2,2H3