2-(4-bromophenyl)-8-chloranyl-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)quinoline-4-carboxamide

Systemtic Name: 2-(4-bromophenyl)-8-chloranyl-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)quinoline-4-carboxamide Openeye Name: 2-(4-bromophenyl)-8-chloro-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)quinoline-4-carboxamide CAS Name: 2-(4-bromophenyl)-8-chloro-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-4-quinolinecarboxamide IUPAC Name: 2-(4-bromophenyl)-8-chloro-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)quinoline-4-carboxamide Traditional Name: 2-(4-bromophenyl)-8-chloro-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)cinchoninamide Formula: C27H21BrClN3OS MolecularWeight: 550.89714

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC(=NC4=C3C=CC=C4Cl)C5=CC=C(C=C5)Br

Isomeric SMILES

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC(=NC4=C3C=CC=C4Cl)C5=CC=C(C=C5)Br

InChI

InChI=1S/C27H21BrClN3OS/c1-2-15-6-11-18-21(14-30)27(34-24(18)12-15)32-26(33)20-13-23(16-7-9-17(28)10-8-16)31-25-19(20)4-3-5-22(25)29/h3-5,7-10,13,15H,2,6,11-12H2,1H3,(H,32,33)