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

Systemtic Name: 8-chloranyl-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-pyridin-3-yl-quinoline-4-carboxamide Openeye Name: 8-chloro-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(3-pyridyl)quinoline-4-carboxamide CAS Name: 8-chloro-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(3-pyridinyl)-4-quinolinecarboxamide IUPAC Name: 8-chloro-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-pyridin-3-ylquinoline-4-carboxamide Traditional Name: 8-chloro-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(3-pyridyl)cinchoninamide Formula: C26H21ClN4OS MolecularWeight: 472.98914

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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=CN=CC=C5

Isomeric SMILES

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

InChI

InChI=1S/C26H21ClN4OS/c1-2-15-8-9-17-20(13-28)26(33-23(17)11-15)31-25(32)19-12-22(16-5-4-10-29-14-16)30-24-18(19)6-3-7-21(24)27/h3-7,10,12,14-15H,2,8-9,11H2,1H3,(H,31,32)