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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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