N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-cyclopropyl-quinoline-4-carboxamide

Systemtic Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-cyclopropyl-quinoline-4-carboxamide Openeye Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-2-cyclopropyl-quinoline-4-carboxamide CAS Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-cyclopropyl-4-quinolinecarboxamide IUPAC Name: N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-2-cyclopropylquinoline-4-carboxamide Traditional Name: N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-cyclopropyl-cinchoninamide Formula: C24H24N4OS MolecularWeight: 416.53856

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC(=NC4=CC=CC=C43)C5CC5

Isomeric SMILES

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC(=NC4=CC=CC=C43)C5CC5

InChI

InChI=1S/C24H24N4OS/c1-30-13-12-21(23-26-19-8-4-5-9-20(19)27-23)28-24(29)17-14-22(15-10-11-15)25-18-7-3-2-6-16(17)18/h2-9,14-15,21H,10-13H2,1H3,(H,26,27)(H,28,29)