N-[[(5-chloranyl-2-methoxy-phenyl)carbonylamino]carbamothioyl]-2-(4-chlorophenyl)quinoline-4-carboxamide

Systemtic Name: N-[[(5-chloranyl-2-methoxy-phenyl)carbonylamino]carbamothioyl]-2-(4-chlorophenyl)quinoline-4-carboxamide Openeye Name: N-[[(5-chloro-2-methoxy-benzoyl)amino]carbamothioyl]-2-(4-chlorophenyl)quinoline-4-carboxamide CAS Name: N-[[[(5-chloro-2-methoxyphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-2-(4-chlorophenyl)-4-quinolinecarboxamide IUPAC Name: N-[[(5-chloro-2-methoxybenzoyl)amino]carbamothioyl]-2-(4-chlorophenyl)quinoline-4-carboxamide Traditional Name: N-[[(5-chloro-2-methoxy-benzoyl)amino]thiocarbamoyl]-2-(4-chlorophenyl)cinchoninamide Formula: C25H18Cl2N4O3S MolecularWeight: 525.40642

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C(=O)NNC(=S)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C(=O)NNC(=S)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H18Cl2N4O3S/c1-34-22-11-10-16(27)12-19(22)24(33)30-31-25(35)29-23(32)18-13-21(14-6-8-15(26)9-7-14)28-20-5-3-2-4-17(18)20/h2-13H,1H3,(H,30,33)(H2,29,31,32,35)