(2R)-2-[(5Z)-5-[(4-bromophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate

Systemtic Name: (2R)-2-[(5Z)-5-[(4-bromophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate Openeye Name: (2R)-2-[(5Z)-5-[(4-bromophenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]hexanoate CAS Name: (2R)-2-[(5Z)-5-[(4-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]hexanoate IUPAC Name: (2R)-2-[(5Z)-5-[(4-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoate Traditional Name: (2R)-2-[(5Z)-5-(4-bromobenzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]hexanoate Formula: C16H15BrNO3S2- MolecularWeight: 413.3292

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)[O-])N1C(=O)C(=CC2=CC=C(C=C2)Br)SC1=S

Isomeric SMILES

CCCC[C@H](C(=O)[O-])N1C(=O)/C(=C/C2=CC=C(C=C2)Br)/SC1=S

InChI

InChI=1S/C16H16BrNO3S2/c1-2-3-4-12(15(20)21)18-14(19)13(23-16(18)22)9-10-5-7-11(17)8-6-10/h5-9,12H,2-4H2,1H3,(H,20,21)/p-1/b13-9-/t12-/m1/s1