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

Systemtic Name: N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-thiophen-2-yl]-2-(2,5-dimethylphenyl)quinoline-4-carboxamide Openeye Name: N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-2-thienyl]-2-(2,5-dimethylphenyl)quinoline-4-carboxamide CAS Name: N-[3-cyano-5-[diethylamino(oxo)methyl]-4-methyl-2-thiophenyl]-2-(2,5-dimethylphenyl)-4-quinolinecarboxamide IUPAC Name: N-[3-cyano-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]-2-(2,5-dimethylphenyl)quinoline-4-carboxamide Traditional Name: N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-2-thienyl]-2-(2,5-dimethylphenyl)cinchoninamide Formula: C29H28N4O2S MolecularWeight: 496.62322

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=C(C=CC(=C4)C)C)C#N)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=C(C=CC(=C4)C)C)C#N)C

InChI

InChI=1S/C29H28N4O2S/c1-6-33(7-2)29(35)26-19(5)23(16-30)28(36-26)32-27(34)22-15-25(21-14-17(3)12-13-18(21)4)31-24-11-9-8-10-20(22)24/h8-15H,6-7H2,1-5H3,(H,32,34)