N-butyl-2-(4-ethylphenyl)sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-butyl-2-(4-ethylphenyl)sulfanyl-quinoline-4-carboxamide Openeye Name: N-butyl-2-(4-ethylphenyl)sulfanyl-quinoline-4-carboxamide CAS Name: N-butyl-2-[(4-ethylphenyl)thio]-4-quinolinecarboxamide IUPAC Name: N-butyl-2-(4-ethylphenyl)sulfanylquinoline-4-carboxamide Traditional Name: N-butyl-2-[(4-ethylphenyl)thio]cinchoninamide Formula: C22H24N2OS MolecularWeight: 364.50376

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC(=NC2=CC=CC=C21)SC3=CC=C(C=C3)CC

Isomeric SMILES

CCCCNC(=O)C1=CC(=NC2=CC=CC=C21)SC3=CC=C(C=C3)CC

InChI

InChI=1S/C22H24N2OS/c1-3-5-14-23-22(25)19-15-21(24-20-9-7-6-8-18(19)20)26-17-12-10-16(4-2)11-13-17/h6-13,15H,3-5,14H2,1-2H3,(H,23,25)