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

Systemtic Name: 8-chloranyl-N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-thiophen-2-yl]-2-(2-methylphenyl)quinoline-4-carboxamide Openeye Name: 8-chloro-N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-2-thienyl]-2-(o-tolyl)quinoline-4-carboxamide CAS Name: 8-chloro-N-[3-cyano-5-[diethylamino(oxo)methyl]-4-methyl-2-thiophenyl]-2-(2-methylphenyl)-4-quinolinecarboxamide IUPAC Name: 8-chloro-N-[3-cyano-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]-2-(2-methylphenyl)quinoline-4-carboxamide Traditional Name: 8-chloro-N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-2-thienyl]-2-(o-tolyl)cinchoninamide Formula: C28H25ClN4O2S MolecularWeight: 517.0417

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=NC3=C2C=CC=C3Cl)C4=CC=CC=C4C)C#N)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=NC3=C2C=CC=C3Cl)C4=CC=CC=C4C)C#N)C

InChI

InChI=1S/C28H25ClN4O2S/c1-5-33(6-2)28(35)25-17(4)21(15-30)27(36-25)32-26(34)20-14-23(18-11-8-7-10-16(18)3)31-24-19(20)12-9-13-22(24)29/h7-14H,5-6H2,1-4H3,(H,32,34)