3-[2-[(5E)-5-[(4-methylphenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoylamino]propanoate

Systemtic Name: 3-[2-[(5E)-5-[(4-methylphenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]ethanoylamino]propanoate Openeye Name: 3-[[2-[(5E)-4-oxo-5-(p-tolylmethylene)-2-thioxo-thiazolidin-3-yl]acetyl]amino]propanoate CAS Name: 3-[[2-[(5E)-5-[(4-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]-1-oxoethyl]amino]propanoate IUPAC Name: 3-[[2-[(5E)-5-[(4-methylphenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]acetyl]amino]propanoate Traditional Name: 3-[[2-[(5E)-4-keto-5-(4-methylbenzylidene)-2-thioxo-thiazolidin-3-yl]acetyl]amino]propionate Formula: C16H15N2O4S2- MolecularWeight: 363.4313

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O4S2/c1-10-2-4-11(5-3-10)8-12-15(22)18(16(23)24-12)9-13(19)17-7-6-14(20)21/h2-5,8H,6-7,9H2,1H3,(H,17,19)(H,20,21)/p-1/b12-8+