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

Systemtic Name: N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-thiophen-2-yl]-2-(3-methylphenyl)quinoline-4-carboxamide Openeye Name: N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-2-thienyl]-2-(m-tolyl)quinoline-4-carboxamide CAS Name: N-[3-cyano-5-[diethylamino(oxo)methyl]-4-methyl-2-thiophenyl]-2-(3-methylphenyl)-4-quinolinecarboxamide IUPAC Name: N-[3-cyano-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]-2-(3-methylphenyl)quinoline-4-carboxamide Traditional Name: N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-2-thienyl]-2-(m-tolyl)cinchoninamide Formula: C28H26N4O2S MolecularWeight: 482.59664

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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=CC(=CC=C4)C)C#N)C

Isomeric SMILES

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

InChI

InChI=1S/C28H26N4O2S/c1-5-32(6-2)28(34)25-18(4)22(16-29)27(35-25)31-26(33)21-15-24(19-11-9-10-17(3)14-19)30-23-13-8-7-12-20(21)23/h7-15H,5-6H2,1-4H3,(H,31,33)