2-[4-[2-[(4Z)-4-[[2,4-bis(oxidanyl)phenyl]methylidene]-5-oxidanylidene-1-phenyl-imidazol-2-yl]sulfanylethanoylamino]phenyl]quinoline-4-carboxylic acid

Systemtic Name: 2-[4-[2-[(4Z)-4-[[2,4-bis(oxidanyl)phenyl]methylidene]-5-oxidanylidene-1-phenyl-imidazol-2-yl]sulfanylethanoylamino]phenyl]quinoline-4-carboxylic acid Openeye Name: 2-[4-[[2-[(4Z)-4-[(2,4-dihydroxyphenyl)methylene]-5-oxo-1-phenyl-imidazol-2-yl]sulfanylacetyl]amino]phenyl]quinoline-4-carboxylic acid CAS Name: 2-[4-[[2-[[(4Z)-4-[(2,4-dihydroxyphenyl)methylidene]-5-oxo-1-phenyl-2-imidazolyl]thio]-1-oxoethyl]amino]phenyl]-4-quinolinecarboxylic acid IUPAC Name: 2-[4-[[2-[(4Z)-4-[(2,4-dihydroxyphenyl)methylidene]-5-oxo-1-phenylimidazol-2-yl]sulfanylacetyl]amino]phenyl]quinoline-4-carboxylic acid Traditional Name: 2-[4-[[2-[[(4Z)-4-(2,4-dihydroxybenzylidene)-5-keto-1-phenyl-2-imidazolin-2-yl]thio]acetyl]amino]phenyl]cinchoninic acid Formula: C34H24N4O6S MolecularWeight: 616.64256

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C(=CC3=C(C=C(C=C3)O)O)N=C2SCC(=O)NC4=CC=C(C=C4)C5=NC6=CC=CC=C6C(=C5)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)/C(=C/C3=C(C=C(C=C3)O)O)/N=C2SCC(=O)NC4=CC=C(C=C4)C5=NC6=CC=CC=C6C(=C5)C(=O)O

InChI

InChI=1S/C34H24N4O6S/c39-24-15-12-21(30(40)17-24)16-29-32(42)38(23-6-2-1-3-7-23)34(37-29)45-19-31(41)35-22-13-10-20(11-14-22)28-18-26(33(43)44)25-8-4-5-9-27(25)36-28/h1-18,39-40H,19H2,(H,35,41)(H,43,44)/b29-16-