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

Systemtic Name: N-[(2-bromophenyl)carbamothioyl]-2-phenyl-quinoline-4-carboxamide Openeye Name: N-[(2-bromophenyl)carbamothioyl]-2-phenyl-quinoline-4-carboxamide CAS Name: N-[(2-bromoanilino)-sulfanylidenemethyl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-[(2-bromophenyl)carbamothioyl]-2-phenylquinoline-4-carboxamide Traditional Name: N-[(2-bromophenyl)thiocarbamoyl]-2-phenyl-cinchoninamide Formula: C23H16BrN3OS MolecularWeight: 462.36164

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(=S)NC4=CC=CC=C4Br

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC(=S)NC4=CC=CC=C4Br

InChI

InChI=1S/C23H16BrN3OS/c24-18-11-5-7-13-20(18)26-23(29)27-22(28)17-14-21(15-8-2-1-3-9-15)25-19-12-6-4-10-16(17)19/h1-14H,(H2,26,27,28,29)