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

Systemtic Name: 6-chloranyl-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2,5-dimethylphenyl)quinoline-4-carboxamide Openeye Name: 6-chloro-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(2,5-dimethylphenyl)quinoline-4-carboxamide CAS Name: 6-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2,5-dimethylphenyl)-4-quinolinecarboxamide IUPAC Name: 6-chloro-N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(2,5-dimethylphenyl)quinoline-4-carboxamide Traditional Name: 6-chloro-N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(2,5-dimethylphenyl)cinchoninamide Formula: C27H22ClN3OS MolecularWeight: 472.00108

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)NC4=C(C5=C(S4)CCCC5)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)NC4=C(C5=C(S4)CCCC5)C#N

InChI

InChI=1S/C27H22ClN3OS/c1-15-7-8-16(2)19(11-15)24-13-21(20-12-17(28)9-10-23(20)30-24)26(32)31-27-22(14-29)18-5-3-4-6-25(18)33-27/h7-13H,3-6H2,1-2H3,(H,31,32)