2-(4-fluorophenyl)-N-methyl-N-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]quinoline-4-carboxamide

Systemtic Name: 2-(4-fluorophenyl)-N-methyl-N-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]quinoline-4-carboxamide Openeye Name: 2-(4-fluorophenyl)-N-methyl-N-[2-(2-methylsulfanylanilino)-2-oxo-ethyl]quinoline-4-carboxamide CAS Name: 2-(4-fluorophenyl)-N-methyl-N-[2-[2-(methylthio)anilino]-2-oxoethyl]-4-quinolinecarboxamide IUPAC Name: 2-(4-fluorophenyl)-N-methyl-N-[2-(2-methylsulfanylanilino)-2-oxoethyl]quinoline-4-carboxamide Traditional Name: 2-(4-fluorophenyl)-N-[2-keto-2-[2-(methylthio)anilino]ethyl]-N-methyl-cinchoninamide Formula: C26H22FN3O2S MolecularWeight: 459.535183

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=CC=C1SC)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)F

Isomeric SMILES

CN(CC(=O)NC1=CC=CC=C1SC)C(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H22FN3O2S/c1-30(16-25(31)29-22-9-5-6-10-24(22)33-2)26(32)20-15-23(17-11-13-18(27)14-12-17)28-21-8-4-3-7-19(20)21/h3-15H,16H2,1-2H3,(H,29,31)