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

Systemtic Name: (2R)-2-[(5E)-4-oxidanylidene-5-[(4-propan-2-ylphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanedioate Openeye Name: (2R)-2-[(5E)-5-[(4-isopropylphenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]pentanedioate CAS Name: (2R)-2-[(5E)-4-oxo-5-[(4-propan-2-ylphenyl)methylidene]-2-sulfanylidene-3-thiazolidinyl]pentanedioate IUPAC Name: (2R)-2-[(5E)-4-oxo-5-[(4-propan-2-ylphenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanedioate Traditional Name: (2R)-2-[(5E)-5-(4-isopropylbenzylidene)-4-keto-2-thioxo-thiazolidin-3-yl]glutarate Formula: C18H17NO5S2-2 MolecularWeight: 391.46128

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19NO5S2/c1-10(2)12-5-3-11(4-6-12)9-14-16(22)19(18(25)26-14)13(17(23)24)7-8-15(20)21/h3-6,9-10,13H,7-8H2,1-2H3,(H,20,21)(H,23,24)/p-2/b14-9+/t13-/m1/s1