N-butan-2-yl-2-(4-ethylphenyl)sulfanyl-quinoline-4-carboxamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)SC2=NC3=CC=CC=C3C(=C2)C(=O)NC(C)CC

Isomeric SMILES

CCC1=CC=C(C=C1)SC2=NC3=CC=CC=C3C(=C2)C(=O)NC(C)CC

InChI

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