N-phenyl-2-[4-(phenylcarbamoyl)quinolin-2-yl]sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-phenyl-2-[4-(phenylcarbamoyl)quinolin-2-yl]sulfanyl-quinoline-4-carboxamide Openeye Name: N-phenyl-2-[[4-(phenylcarbamoyl)-2-quinolyl]sulfanyl]quinoline-4-carboxamide CAS Name: 2-[[4-[anilino(oxo)methyl]-2-quinolinyl]thio]-N-phenyl-4-quinolinecarboxamide IUPAC Name: N-phenyl-2-[4-(phenylcarbamoyl)quinolin-2-yl]sulfanylquinoline-4-carboxamide Traditional Name: N-phenyl-2-[[4-(phenylcarbamoyl)-2-quinolyl]thio]cinchoninamide Formula: C32H22N4O2S MolecularWeight: 526.60768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)SC4=NC5=CC=CC=C5C(=C4)C(=O)NC6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)SC4=NC5=CC=CC=C5C(=C4)C(=O)NC6=CC=CC=C6

InChI

InChI=1S/C32H22N4O2S/c37-31(33-21-11-3-1-4-12-21)25-19-29(35-27-17-9-7-15-23(25)27)39-30-20-26(24-16-8-10-18-28(24)36-30)32(38)34-22-13-5-2-6-14-22/h1-20H,(H,33,37)(H,34,38)