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

Systemtic Name: 7-chloranyl-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-8-methyl-2-pyridin-2-yl-quinoline-4-carboxamide Openeye Name: 7-chloro-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-8-methyl-2-(2-pyridyl)quinoline-4-carboxamide CAS Name: 7-chloro-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-8-methyl-2-(2-pyridinyl)-4-quinolinecarboxamide IUPAC Name: 7-chloro-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-8-methyl-2-pyridin-2-ylquinoline-4-carboxamide Traditional Name: 7-chloro-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-8-methyl-2-(2-pyridyl)cinchoninamide Formula: C27H23ClN4OS MolecularWeight: 487.01572

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC(=NC4=C3C=CC(=C4C)Cl)C5=CC=CC=N5

Isomeric SMILES

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC(=NC4=C3C=CC(=C4C)Cl)C5=CC=CC=N5

InChI

InChI=1S/C27H23ClN4OS/c1-3-16-7-8-17-20(14-29)27(34-24(17)12-16)32-26(33)19-13-23(22-6-4-5-11-30-22)31-25-15(2)21(28)10-9-18(19)25/h4-6,9-11,13,16H,3,7-8,12H2,1-2H3,(H,32,33)