N-(5-chloranyl-2-cyano-phenyl)-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-(5-chloranyl-2-cyano-phenyl)-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-(5-chloro-2-cyano-phenyl)-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-(5-chloro-2-cyanophenyl)-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-(5-chloro-2-cyanophenyl)-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-(5-chloro-2-cyano-phenyl)-2-(2-thienyl)cinchoninamide Formula: C21H12ClN3OS MolecularWeight: 389.85748

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=C(C=CC(=C4)Cl)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=C(C=CC(=C4)Cl)C#N

InChI

InChI=1S/C21H12ClN3OS/c22-14-8-7-13(12-23)18(10-14)25-21(26)16-11-19(20-6-3-9-27-20)24-17-5-2-1-4-15(16)17/h1-11H,(H,25,26)