N-(cyclohexylcarbamothioyl)-2-phenyl-quinoline-4-carboxamide

Systemtic Name: N-(cyclohexylcarbamothioyl)-2-phenyl-quinoline-4-carboxamide Openeye Name: N-(cyclohexylcarbamothioyl)-2-phenyl-quinoline-4-carboxamide CAS Name: N-[(cyclohexylamino)-sulfanylidenemethyl]-2-phenyl-4-quinolinecarboxamide IUPAC Name: N-(cyclohexylcarbamothioyl)-2-phenylquinoline-4-carboxamide Traditional Name: N-(cyclohexylthiocarbamoyl)-2-phenyl-cinchoninamide Formula: C23H23N3OS MolecularWeight: 389.51322

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)NC(=S)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C23H23N3OS/c27-22(26-23(28)24-17-11-5-2-6-12-17)19-15-21(16-9-3-1-4-10-16)25-20-14-8-7-13-18(19)20/h1,3-4,7-10,13-15,17H,2,5-6,11-12H2,(H2,24,26,27,28)