2-[(2-acetamido-1,3-thiazol-4-yl)methylsulfanyl]-N-(2-methoxyphenyl)quinoline-4-carboxamide

Systemtic Name: 2-[(2-acetamido-1,3-thiazol-4-yl)methylsulfanyl]-N-(2-methoxyphenyl)quinoline-4-carboxamide Openeye Name: 2-[(2-acetamidothiazol-4-yl)methylsulfanyl]-N-(2-methoxyphenyl)quinoline-4-carboxamide CAS Name: 2-[(2-acetamido-4-thiazolyl)methylthio]-N-(2-methoxyphenyl)-4-quinolinecarboxamide IUPAC Name: 2-[(2-acetamido-1,3-thiazol-4-yl)methylsulfanyl]-N-(2-methoxyphenyl)quinoline-4-carboxamide Traditional Name: 2-[(2-acetamidothiazol-4-yl)methylthio]-N-(2-methoxyphenyl)cinchoninamide Formula: C23H20N4O3S2 MolecularWeight: 464.5599

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=NC(=CS1)CSC2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=CC=C4OC

Isomeric SMILES

CC(=O)NC1=NC(=CS1)CSC2=NC3=CC=CC=C3C(=C2)C(=O)NC4=CC=CC=C4OC

InChI

InChI=1S/C23H20N4O3S2/c1-14(28)24-23-25-15(13-32-23)12-31-21-11-17(16-7-3-4-8-18(16)26-21)22(29)27-19-9-5-6-10-20(19)30-2/h3-11,13H,12H2,1-2H3,(H,27,29)(H,24,25,28)