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

Systemtic Name: 2-[4-[2-[(4Z)-4-[(2-methoxyphenyl)methylidene]-5-oxidanylidene-1-phenyl-imidazol-2-yl]sulfanylethanoylamino]phenyl]quinoline-4-carboxylic acid Openeye Name: 2-[4-[[2-[(4Z)-4-[(2-methoxyphenyl)methylene]-5-oxo-1-phenyl-imidazol-2-yl]sulfanylacetyl]amino]phenyl]quinoline-4-carboxylic acid CAS Name: 2-[4-[[2-[[(4Z)-4-[(2-methoxyphenyl)methylidene]-5-oxo-1-phenyl-2-imidazolyl]thio]-1-oxoethyl]amino]phenyl]-4-quinolinecarboxylic acid IUPAC Name: 2-[4-[[2-[(4Z)-4-[(2-methoxyphenyl)methylidene]-5-oxo-1-phenylimidazol-2-yl]sulfanylacetyl]amino]phenyl]quinoline-4-carboxylic acid Traditional Name: 2-[4-[[2-[[(4Z)-5-keto-4-o-anisylidene-1-phenyl-2-imidazolin-2-yl]thio]acetyl]amino]phenyl]cinchoninic acid Formula: C35H26N4O5S MolecularWeight: 614.66974

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C=C2C(=O)N(C(=N2)SCC(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5C(=C4)C(=O)O)C6=CC=CC=C6

Isomeric SMILES

COC1=CC=CC=C1/C=C\2/C(=O)N(C(=N2)SCC(=O)NC3=CC=C(C=C3)C4=NC5=CC=CC=C5C(=C4)C(=O)O)C6=CC=CC=C6

InChI

InChI=1S/C35H26N4O5S/c1-44-31-14-8-5-9-23(31)19-30-33(41)39(25-10-3-2-4-11-25)35(38-30)45-21-32(40)36-24-17-15-22(16-18-24)29-20-27(34(42)43)26-12-6-7-13-28(26)37-29/h2-20H,21H2,1H3,(H,36,40)(H,42,43)/b30-19-