2-(4-methylphenyl)sulfanyl-N-(1-phenylethyl)quinoline-4-carboxamide

Systemtic Name: 2-(4-methylphenyl)sulfanyl-N-(1-phenylethyl)quinoline-4-carboxamide Openeye Name: N-(1-phenylethyl)-2-(p-tolylsulfanyl)quinoline-4-carboxamide CAS Name: 2-[(4-methylphenyl)thio]-N-(1-phenylethyl)-4-quinolinecarboxamide IUPAC Name: 2-(4-methylphenyl)sulfanyl-N-(1-phenylethyl)quinoline-4-carboxamide Traditional Name: N-(1-phenylethyl)-2-(p-tolylthio)cinchoninamide Formula: C25H22N2OS MolecularWeight: 398.51998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC3=CC=CC=C3C(=C2)C(=O)NC(C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC3=CC=CC=C3C(=C2)C(=O)NC(C)C4=CC=CC=C4

InChI

InChI=1S/C25H22N2OS/c1-17-12-14-20(15-13-17)29-24-16-22(21-10-6-7-11-23(21)27-24)25(28)26-18(2)19-8-4-3-5-9-19/h3-16,18H,1-2H3,(H,26,28)