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

Systemtic Name: 7-chloranyl-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-8-methyl-2-(4-propylphenyl)quinoline-4-carboxamide Openeye Name: 7-chloro-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-8-methyl-2-(4-propylphenyl)quinoline-4-carboxamide CAS Name: 7-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-8-methyl-2-(4-propylphenyl)-4-quinolinecarboxamide IUPAC Name: 7-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-8-methyl-2-(4-propylphenyl)quinoline-4-carboxamide Traditional Name: 7-chloro-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-8-methyl-2-(4-propylphenyl)cinchoninamide Formula: C29H26ClN3OS MolecularWeight: 500.05424

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3C)Cl)C(=C2)C(=O)NC4=C(C5=C(S4)CCCC5)C#N

Isomeric SMILES

CCCC1=CC=C(C=C1)C2=NC3=C(C=CC(=C3C)Cl)C(=C2)C(=O)NC4=C(C5=C(S4)CCCC5)C#N

InChI

InChI=1S/C29H26ClN3OS/c1-3-6-18-9-11-19(12-10-18)25-15-22(21-13-14-24(30)17(2)27(21)32-25)28(34)33-29-23(16-31)20-7-4-5-8-26(20)35-29/h9-15H,3-8H2,1-2H3,(H,33,34)