6-[5-[(3-methylphenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid

Systemtic Name: 6-[5-[(3-methylphenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid Openeye Name: 6-[5-(m-tolylmethylene)-4-oxo-2-thioxo-thiazolidin-3-yl]hexanoic acid CAS Name: 6-[5-[(3-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]hexanoic acid IUPAC Name: 6-[5-[(3-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]hexanoic acid Traditional Name: 6-[4-keto-5-(3-methylbenzylidene)-2-thioxo-thiazolidin-3-yl]hexanoic acid Formula: C17H19NO3S2 MolecularWeight: 349.46766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C=C2C(=O)N(C(=S)S2)CCCCCC(=O)O

Isomeric SMILES

CC1=CC=CC(=C1)C=C2C(=O)N(C(=S)S2)CCCCCC(=O)O

InChI

InChI=1S/C17H19NO3S2/c1-12-6-5-7-13(10-12)11-14-16(21)18(17(22)23-14)9-4-2-3-8-15(19)20/h5-7,10-11H,2-4,8-9H2,1H3,(H,19,20)