2-phenyl-N-[(2-phenylethanoylamino)carbamothioyl]quinoline-4-carboxamide

Systemtic Name: 2-phenyl-N-[(2-phenylethanoylamino)carbamothioyl]quinoline-4-carboxamide Openeye Name: 2-phenyl-N-[[(2-phenylacetyl)amino]carbamothioyl]quinoline-4-carboxamide CAS Name: N-[[(1-oxo-2-phenylethyl)hydrazo]-sulfanylidenemethyl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: 2-phenyl-N-[[(2-phenylacetyl)amino]carbamothioyl]quinoline-4-carboxamide Traditional Name: 2-phenyl-N-[[(2-phenylacetyl)amino]thiocarbamoyl]cinchoninamide Formula: C25H20N4O2S MolecularWeight: 440.5169

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H20N4O2S/c30-23(15-17-9-3-1-4-10-17)28-29-25(32)27-24(31)20-16-22(18-11-5-2-6-12-18)26-21-14-8-7-13-19(20)21/h1-14,16H,15H2,(H,28,30)(H2,27,29,31,32)