N-[(5E)-5-[(5-bromanyl-2-butoxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide

Systemtic Name: N-[(5E)-5-[(5-bromanyl-2-butoxy-phenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide Openeye Name: N-[(5E)-5-[(5-bromo-2-butoxy-phenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]benzamide CAS Name: N-[(5E)-5-[(5-bromo-2-butoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]benzamide IUPAC Name: N-[(5E)-5-[(5-bromo-2-butoxyphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]benzamide Traditional Name: N-[(5E)-5-(5-bromo-2-butoxy-benzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]benzamide Formula: C21H19BrN2O3S2 MolecularWeight: 491.42116

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)Br)C=C2C(=O)N(C(=S)S2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)Br)/C=C/2\C(=O)N(C(=S)S2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H19BrN2O3S2/c1-2-3-11-27-17-10-9-16(22)12-15(17)13-18-20(26)24(21(28)29-18)23-19(25)14-7-5-4-6-8-14/h4-10,12-13H,2-3,11H2,1H3,(H,23,25)/b18-13+