N-(3-methylbutyl)-2-(3-methylsulfanylphenyl)sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-(3-methylbutyl)-2-(3-methylsulfanylphenyl)sulfanyl-quinoline-4-carboxamide Openeye Name: N-isopentyl-2-(3-methylsulfanylphenyl)sulfanyl-quinoline-4-carboxamide CAS Name: N-(3-methylbutyl)-2-[[3-(methylthio)phenyl]thio]-4-quinolinecarboxamide IUPAC Name: N-(3-methylbutyl)-2-(3-methylsulfanylphenyl)sulfanylquinoline-4-carboxamide Traditional Name: N-isoamyl-2-[[3-(methylthio)phenyl]thio]cinchoninamide Formula: C22H24N2OS2 MolecularWeight: 396.56876

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CC(=NC2=CC=CC=C21)SC3=CC(=CC=C3)SC

Isomeric SMILES

CC(C)CCNC(=O)C1=CC(=NC2=CC=CC=C21)SC3=CC(=CC=C3)SC

InChI

InChI=1S/C22H24N2OS2/c1-15(2)11-12-23-22(25)19-14-21(24-20-10-5-4-9-18(19)20)27-17-8-6-7-16(13-17)26-3/h4-10,13-15H,11-12H2,1-3H3,(H,23,25)