2-[2-[(4Z)-4-[(4-methylphenyl)methylidene]-5-oxidanylidene-1-phenyl-imidazol-2-yl]sulfanylethanoylamino]benzoic acid

Systemtic Name: 2-[2-[(4Z)-4-[(4-methylphenyl)methylidene]-5-oxidanylidene-1-phenyl-imidazol-2-yl]sulfanylethanoylamino]benzoic acid Openeye Name: 2-[[2-[(4Z)-5-oxo-1-phenyl-4-(p-tolylmethylene)imidazol-2-yl]sulfanylacetyl]amino]benzoic acid CAS Name: 2-[[2-[[(4Z)-4-[(4-methylphenyl)methylidene]-5-oxo-1-phenyl-2-imidazolyl]thio]-1-oxoethyl]amino]benzoic acid IUPAC Name: 2-[[2-[(4Z)-4-[(4-methylphenyl)methylidene]-5-oxo-1-phenylimidazol-2-yl]sulfanylacetyl]amino]benzoic acid Traditional Name: 2-[[2-[[(4Z)-5-keto-4-(4-methylbenzylidene)-1-phenyl-2-imidazolin-2-yl]thio]acetyl]amino]benzoic acid Formula: C26H21N3O4S MolecularWeight: 471.52764

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C2C(=O)N(C(=N2)SCC(=O)NC3=CC=CC=C3C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)/C=C\2/C(=O)N(C(=N2)SCC(=O)NC3=CC=CC=C3C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C26H21N3O4S/c1-17-11-13-18(14-12-17)15-22-24(31)29(19-7-3-2-4-8-19)26(28-22)34-16-23(30)27-21-10-6-5-9-20(21)25(32)33/h2-15H,16H2,1H3,(H,27,30)(H,32,33)/b22-15-