N-methyl-2-[(3-methylsulfanylphenyl)amino]-N-(phenylmethyl)quinoline-4-carboxamide

Systemtic Name: N-methyl-2-[(3-methylsulfanylphenyl)amino]-N-(phenylmethyl)quinoline-4-carboxamide Openeye Name: N-benzyl-N-methyl-2-(3-methylsulfanylanilino)quinoline-4-carboxamide CAS Name: N-methyl-2-[3-(methylthio)anilino]-N-(phenylmethyl)-4-quinolinecarboxamide IUPAC Name: N-benzyl-N-methyl-2-(3-methylsulfanylanilino)quinoline-4-carboxamide Traditional Name: N-benzyl-N-methyl-2-[3-(methylthio)anilino]cinchoninamide Formula: C25H23N3OS MolecularWeight: 413.53462

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=O)C2=CC(=NC3=CC=CC=C32)NC4=CC(=CC=C4)SC

Isomeric SMILES

CN(CC1=CC=CC=C1)C(=O)C2=CC(=NC3=CC=CC=C32)NC4=CC(=CC=C4)SC

InChI

InChI=1S/C25H23N3OS/c1-28(17-18-9-4-3-5-10-18)25(29)22-16-24(27-23-14-7-6-13-21(22)23)26-19-11-8-12-20(15-19)30-2/h3-16H,17H2,1-2H3,(H,26,27)