(2R)-2-[(5E)-5-[(3-methylphenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-4-methylsulfanyl-butanoate

Systemtic Name: (2R)-2-[(5E)-5-[(3-methylphenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]-4-methylsulfanyl-butanoate Openeye Name: (2R)-4-methylsulfanyl-2-[(5E)-5-(m-tolylmethylene)-4-oxo-2-thioxo-thiazolidin-3-yl]butanoate CAS Name: (2R)-2-[(5E)-5-[(3-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-4-(methylthio)butanoate IUPAC Name: (2R)-2-[(5E)-5-[(3-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[(5E)-4-keto-5-(3-methylbenzylidene)-2-thioxo-thiazolidin-3-yl]-4-(methylthio)butyrate Formula: C16H16NO3S3- MolecularWeight: 366.49814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C=C2C(=O)N(C(=S)S2)C(CCSC)C(=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)/C=C/2\C(=O)N(C(=S)S2)[C@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C16H17NO3S3/c1-10-4-3-5-11(8-10)9-13-14(18)17(16(21)23-13)12(15(19)20)6-7-22-2/h3-5,8-9,12H,6-7H2,1-2H3,(H,19,20)/p-1/b13-9+/t12-/m1/s1