N-[3-(diethylamino)propyl]-2-[(3-methylsulfanylphenyl)amino]quinoline-4-carboxamide

Systemtic Name: N-[3-(diethylamino)propyl]-2-[(3-methylsulfanylphenyl)amino]quinoline-4-carboxamide Openeye Name: N-[3-(diethylamino)propyl]-2-(3-methylsulfanylanilino)quinoline-4-carboxamide CAS Name: N-[3-(diethylamino)propyl]-2-[3-(methylthio)anilino]-4-quinolinecarboxamide IUPAC Name: N-[3-(diethylamino)propyl]-2-(3-methylsulfanylanilino)quinoline-4-carboxamide Traditional Name: N-[3-(diethylamino)propyl]-2-[3-(methylthio)anilino]cinchoninamide Formula: C24H30N4OS MolecularWeight: 422.5862

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC(=O)C1=CC(=NC2=CC=CC=C21)NC3=CC(=CC=C3)SC

Isomeric SMILES

CCN(CC)CCCNC(=O)C1=CC(=NC2=CC=CC=C21)NC3=CC(=CC=C3)SC

InChI

InChI=1S/C24H30N4OS/c1-4-28(5-2)15-9-14-25-24(29)21-17-23(27-22-13-7-6-12-20(21)22)26-18-10-8-11-19(16-18)30-3/h6-8,10-13,16-17H,4-5,9,14-15H2,1-3H3,(H,25,29)(H,26,27)