2-(5-ethylthiophen-2-yl)-N-(3-methylsulfanylphenyl)quinoline-4-carboxamide

Systemtic Name: 2-(5-ethylthiophen-2-yl)-N-(3-methylsulfanylphenyl)quinoline-4-carboxamide Openeye Name: 2-(5-ethyl-2-thienyl)-N-(3-methylsulfanylphenyl)quinoline-4-carboxamide CAS Name: 2-(5-ethyl-2-thiophenyl)-N-[3-(methylthio)phenyl]-4-quinolinecarboxamide IUPAC Name: 2-(5-ethylthiophen-2-yl)-N-(3-methylsulfanylphenyl)quinoline-4-carboxamide Traditional Name: 2-(5-ethyl-2-thienyl)-N-[3-(methylthio)phenyl]cinchoninamide Formula: C23H20N2OS2 MolecularWeight: 404.5477

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC(=CC=C4)SC

Isomeric SMILES

CCC1=CC=C(S1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC(=CC=C4)SC

InChI

InChI=1S/C23H20N2OS2/c1-3-16-11-12-22(28-16)21-14-19(18-9-4-5-10-20(18)25-21)23(26)24-15-7-6-8-17(13-15)27-2/h4-14H,3H2,1-2H3,(H,24,26)