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

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-5-[(3-bromanyl-4-ethoxy-5-methoxy-phenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-5-[(3-bromo-4-ethoxy-5-methoxy-phenyl)methylene]-2-thioxo-thiazolidin-4-one CAS Name: 3-(1,3-benzodioxol-5-yl)-5-[(3-bromo-4-ethoxy-5-methoxyphenyl)methylidene]-2-sulfanylidene-4-thiazolidinone IUPAC Name: 3-(1,3-benzodioxol-5-yl)-5-[(3-bromo-4-ethoxy-5-methoxyphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-5-(3-bromo-4-ethoxy-5-methoxy-benzylidene)-2-thioxo-thiazolidin-4-one Formula: C20H16BrNO5S2 MolecularWeight: 494.37874

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C=C2C(=O)N(C(=S)S2)C3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C=C2C(=O)N(C(=S)S2)C3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C20H16BrNO5S2/c1-3-25-18-13(21)6-11(7-16(18)24-2)8-17-19(23)22(20(28)29-17)12-4-5-14-15(9-12)27-10-26-14/h4-9H,3,10H2,1-2H3