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

Systemtic Name: 2-(5-chloranylthiophen-2-yl)-N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-thiophen-2-yl]quinoline-4-carboxamide Openeye Name: 2-(5-chloro-2-thienyl)-N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-2-thienyl]quinoline-4-carboxamide CAS Name: 2-(5-chloro-2-thiophenyl)-N-[3-cyano-5-[diethylamino(oxo)methyl]-4-methyl-2-thiophenyl]-4-quinolinecarboxamide IUPAC Name: 2-(5-chlorothiophen-2-yl)-N-[3-cyano-5-(diethylcarbamoyl)-4-methylthiophen-2-yl]quinoline-4-carboxamide Traditional Name: 2-(5-chloro-2-thienyl)-N-[3-cyano-5-(diethylcarbamoyl)-4-methyl-2-thienyl]cinchoninamide Formula: C25H21ClN4O2S2 MolecularWeight: 509.04284

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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=C(S4)Cl)C#N)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(C(=C(S1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(S4)Cl)C#N)C

InChI

InChI=1S/C25H21ClN4O2S2/c1-4-30(5-2)25(32)22-14(3)17(13-27)24(34-22)29-23(31)16-12-19(20-10-11-21(26)33-20)28-18-9-7-6-8-15(16)18/h6-12H,4-5H2,1-3H3,(H,29,31)