N-(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)-7,8-dimethyl-2-pyridin-3-yl-quinoline-4-carboxamide

Systemtic Name: N-(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)-7,8-dimethyl-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-7,8-dimethyl-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: N-(3-cyano-4-ethyl-5-methyl-2-thiophenyl)-7,8-dimethyl-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-7,8-dimethyl-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-7,8-dimethyl-2-(3-pyridyl)cinchoninamide Formula: C25H22N4OS MolecularWeight: 426.53338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1C#N)NC(=O)C2=CC(=NC3=C2C=CC(=C3C)C)C4=CN=CC=C4)C

Isomeric SMILES

CCC1=C(SC(=C1C#N)NC(=O)C2=CC(=NC3=C2C=CC(=C3C)C)C4=CN=CC=C4)C

InChI

InChI=1S/C25H22N4OS/c1-5-18-16(4)31-25(21(18)12-26)29-24(30)20-11-22(17-7-6-10-27-13-17)28-23-15(3)14(2)8-9-19(20)23/h6-11,13H,5H2,1-4H3,(H,29,30)