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

Systemtic Name: N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-thiophen-2-yl]-2-(2,4-dichlorophenyl)-3-methyl-quinoline-4-carboxamide Openeye Name: N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-2-thienyl]-2-(2,4-dichlorophenyl)-3-methyl-quinoline-4-carboxamide CAS Name: N-[3-cyano-5-[diethylamino(oxo)methyl]-4-methyl-2-thiophenyl]-2-(2,4-dichlorophenyl)-3-methyl-4-quinolinecarboxamide IUPAC Name: N-[3-cyano-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]-2-(2,4-dichlorophenyl)-3-methylquinoline-4-carboxamide Traditional Name: N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-2-thienyl]-2-(2,4-dichlorophenyl)-3-methyl-cinchoninamide Formula: C28H24Cl2N4O2S MolecularWeight: 551.48676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H24Cl2N4O2S/c1-5-34(6-2)28(36)25-15(3)20(14-31)27(37-25)33-26(35)23-16(4)24(18-12-11-17(29)13-21(18)30)32-22-10-8-7-9-19(22)23/h7-13H,5-6H2,1-4H3,(H,33,35)