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

Systemtic Name: (2R)-2-[(5E)-5-[(3-bromophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanedioate Openeye Name: (2R)-2-[(5E)-5-[(3-bromophenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]pentanedioate CAS Name: (2R)-2-[(5E)-5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]pentanedioate IUPAC Name: (2R)-2-[(5E)-5-[(3-bromophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanedioate Traditional Name: (2R)-2-[(5E)-5-(3-bromobenzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]glutarate Formula: C15H10BrNO5S2-2 MolecularWeight: 428.2776

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Br)C=C2C(=O)N(C(=S)S2)C(CCC(=O)[O-])C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Br)/C=C/2\C(=O)N(C(=S)S2)[C@H](CCC(=O)[O-])C(=O)[O-]

InChI

InChI=1S/C15H12BrNO5S2/c16-9-3-1-2-8(6-9)7-11-13(20)17(15(23)24-11)10(14(21)22)4-5-12(18)19/h1-3,6-7,10H,4-5H2,(H,18,19)(H,21,22)/p-2/b11-7+/t10-/m1/s1