N-cyclopentyl-2-(2-methylsulfanylphenyl)sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-cyclopentyl-2-(2-methylsulfanylphenyl)sulfanyl-quinoline-4-carboxamide Openeye Name: N-cyclopentyl-2-(2-methylsulfanylphenyl)sulfanyl-quinoline-4-carboxamide CAS Name: N-cyclopentyl-2-[[2-(methylthio)phenyl]thio]-4-quinolinecarboxamide IUPAC Name: N-cyclopentyl-2-(2-methylsulfanylphenyl)sulfanylquinoline-4-carboxamide Traditional Name: N-cyclopentyl-2-[[2-(methylthio)phenyl]thio]cinchoninamide Formula: C22H22N2OS2 MolecularWeight: 394.55288

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1SC2=NC3=CC=CC=C3C(=C2)C(=O)NC4CCCC4

Isomeric SMILES

CSC1=CC=CC=C1SC2=NC3=CC=CC=C3C(=C2)C(=O)NC4CCCC4

InChI

InChI=1S/C22H22N2OS2/c1-26-19-12-6-7-13-20(19)27-21-14-17(16-10-4-5-11-18(16)24-21)22(25)23-15-8-2-3-9-15/h4-7,10-15H,2-3,8-9H2,1H3,(H,23,25)