2-(5-chloranylthiophen-2-yl)-N-(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)quinoline-4-carboxamide

Systemtic Name: 2-(5-chloranylthiophen-2-yl)-N-(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)quinoline-4-carboxamide Openeye Name: 2-(5-chloro-2-thienyl)-N-(3-cyano-4-ethyl-5-methyl-2-thienyl)quinoline-4-carboxamide CAS Name: 2-(5-chloro-2-thiophenyl)-N-(3-cyano-4-ethyl-5-methyl-2-thiophenyl)-4-quinolinecarboxamide IUPAC Name: 2-(5-chlorothiophen-2-yl)-N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)quinoline-4-carboxamide Traditional Name: 2-(5-chloro-2-thienyl)-N-(3-cyano-4-ethyl-5-methyl-2-thienyl)cinchoninamide Formula: C22H16ClN3OS2 MolecularWeight: 437.96494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C#N)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(S4)Cl)C

Isomeric SMILES

CCC1=C(SC(=C1C#N)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(S4)Cl)C

InChI

InChI=1S/C22H16ClN3OS2/c1-3-13-12(2)28-22(16(13)11-24)26-21(27)15-10-18(19-8-9-20(23)29-19)25-17-7-5-4-6-14(15)17/h4-10H,3H2,1-2H3,(H,26,27)