2-[4-[2-[(4Z)-4-[(3-chlorophenyl)methylidene]-5-oxidanylidene-1-phenyl-imidazol-2-yl]sulfanylethanoylamino]phenyl]quinoline-4-carboxylic acid

Systemtic Name: 2-[4-[2-[(4Z)-4-[(3-chlorophenyl)methylidene]-5-oxidanylidene-1-phenyl-imidazol-2-yl]sulfanylethanoylamino]phenyl]quinoline-4-carboxylic acid Openeye Name: 2-[4-[[2-[(4Z)-4-[(3-chlorophenyl)methylene]-5-oxo-1-phenyl-imidazol-2-yl]sulfanylacetyl]amino]phenyl]quinoline-4-carboxylic acid CAS Name: 2-[4-[[2-[[(4Z)-4-[(3-chlorophenyl)methylidene]-5-oxo-1-phenyl-2-imidazolyl]thio]-1-oxoethyl]amino]phenyl]-4-quinolinecarboxylic acid IUPAC Name: 2-[4-[[2-[(4Z)-4-[(3-chlorophenyl)methylidene]-5-oxo-1-phenylimidazol-2-yl]sulfanylacetyl]amino]phenyl]quinoline-4-carboxylic acid Traditional Name: 2-[4-[[2-[[(4Z)-4-(3-chlorobenzylidene)-5-keto-1-phenyl-2-imidazolin-2-yl]thio]acetyl]amino]phenyl]cinchoninic acid Formula: C34H23ClN4O4S MolecularWeight: 619.08882

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C34H23ClN4O4S/c35-23-8-6-7-21(17-23)18-30-32(41)39(25-9-2-1-3-10-25)34(38-30)44-20-31(40)36-24-15-13-22(14-16-24)29-19-27(33(42)43)26-11-4-5-12-28(26)37-29/h1-19H,20H2,(H,36,40)(H,42,43)/b30-18-