N-(2,2-diethoxyethyl)-2-(4-methylphenyl)sulfanyl-quinoline-4-carboxamide

Systemtic Name: N-(2,2-diethoxyethyl)-2-(4-methylphenyl)sulfanyl-quinoline-4-carboxamide Openeye Name: N-(2,2-diethoxyethyl)-2-(p-tolylsulfanyl)quinoline-4-carboxamide CAS Name: N-(2,2-diethoxyethyl)-2-[(4-methylphenyl)thio]-4-quinolinecarboxamide IUPAC Name: N-(2,2-diethoxyethyl)-2-(4-methylphenyl)sulfanylquinoline-4-carboxamide Traditional Name: N-(2,2-diethoxyethyl)-2-(p-tolylthio)cinchoninamide Formula: C23H26N2O3S MolecularWeight: 410.52914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(CNC(=O)C1=CC(=NC2=CC=CC=C21)SC3=CC=C(C=C3)C)OCC

Isomeric SMILES

CCOC(CNC(=O)C1=CC(=NC2=CC=CC=C21)SC3=CC=C(C=C3)C)OCC

InChI

InChI=1S/C23H26N2O3S/c1-4-27-22(28-5-2)15-24-23(26)19-14-21(25-20-9-7-6-8-18(19)20)29-17-12-10-16(3)11-13-17/h6-14,22H,4-5,15H2,1-3H3,(H,24,26)