4-[[(5Z)-3-ethyl-5-[(4-ethylphenyl)methylidene]-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoic acid

Systemtic Name: 4-[[(5Z)-3-ethyl-5-[(4-ethylphenyl)methylidene]-4-oxidanylidene-1,3-thiazolidin-2-ylidene]amino]benzoic acid Openeye Name: 4-[[(5Z)-3-ethyl-5-[(4-ethylphenyl)methylene]-4-oxo-thiazolidin-2-ylidene]amino]benzoic acid CAS Name: 4-[[(5Z)-3-ethyl-5-[(4-ethylphenyl)methylidene]-4-oxo-2-thiazolidinylidene]amino]benzoic acid IUPAC Name: 4-[[(5Z)-3-ethyl-5-[(4-ethylphenyl)methylidene]-4-oxo-1,3-thiazolidin-2-ylidene]amino]benzoic acid Traditional Name: 4-[[(5Z)-3-ethyl-5-(4-ethylbenzylidene)-4-keto-thiazolidin-2-ylidene]amino]benzoic acid Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C=C2C(=O)N(C(=NC3=CC=C(C=C3)C(=O)O)S2)CC

Isomeric SMILES

CCC1=CC=C(C=C1)/C=C\2/C(=O)N(C(=NC3=CC=C(C=C3)C(=O)O)S2)CC

InChI

InChI=1S/C21H20N2O3S/c1-3-14-5-7-15(8-6-14)13-18-19(24)23(4-2)21(27-18)22-17-11-9-16(10-12-17)20(25)26/h5-13H,3-4H2,1-2H3,(H,25,26)/b18-13-,22-21?