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

Systemtic Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-6-ethyl-2-(5-ethylthiophen-2-yl)quinoline-4-carboxamide Openeye Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-6-ethyl-2-(5-ethyl-2-thienyl)quinoline-4-carboxamide CAS Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-6-ethyl-2-(5-ethyl-2-thiophenyl)-4-quinolinecarboxamide IUPAC Name: N-(3-cyano-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-6-ethyl-2-(5-ethylthiophen-2-yl)quinoline-4-carboxamide Traditional Name: N-(3-cyano-4,5,6,7-tetrahydrobenzothiophen-2-yl)-6-ethyl-2-(5-ethyl-2-thienyl)cinchoninamide Formula: C27H25N3OS2 MolecularWeight: 471.6369

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(C=C2C(=O)NC3=C(C4=C(S3)CCCC4)C#N)C5=CC=C(S5)CC

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(C=C2C(=O)NC3=C(C4=C(S3)CCCC4)C#N)C5=CC=C(S5)CC

InChI

InChI=1S/C27H25N3OS2/c1-3-16-9-11-22-19(13-16)20(14-23(29-22)25-12-10-17(4-2)32-25)26(31)30-27-21(15-28)18-7-5-6-8-24(18)33-27/h9-14H,3-8H2,1-2H3,(H,30,31)