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

Systemtic Name: N-(3-cyano-4-ethyl-5-methyl-thiophen-2-yl)-2-(2,4-dimethylphenyl)quinoline-4-carboxamide Openeye Name: N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-2-(2,4-dimethylphenyl)quinoline-4-carboxamide CAS Name: N-(3-cyano-4-ethyl-5-methyl-2-thiophenyl)-2-(2,4-dimethylphenyl)-4-quinolinecarboxamide IUPAC Name: N-(3-cyano-4-ethyl-5-methylthiophen-2-yl)-2-(2,4-dimethylphenyl)quinoline-4-carboxamide Traditional Name: N-(3-cyano-4-ethyl-5-methyl-2-thienyl)-2-(2,4-dimethylphenyl)cinchoninamide Formula: C26H23N3OS MolecularWeight: 425.54532

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H23N3OS/c1-5-18-17(4)31-26(22(18)14-27)29-25(30)21-13-24(19-11-10-15(2)12-16(19)3)28-23-9-7-6-8-20(21)23/h6-13H,5H2,1-4H3,(H,29,30)