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

Systemtic Name: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,6,8-trimethyl-2-(4-methylphenyl)quinoline-4-carboxamide Openeye Name: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3,6,8-trimethyl-2-(p-tolyl)quinoline-4-carboxamide CAS Name: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,6,8-trimethyl-2-(4-methylphenyl)-4-quinolinecarboxamide IUPAC Name: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3,6,8-trimethyl-2-(4-methylphenyl)quinoline-4-carboxamide Traditional Name: N-(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3,6,8-trimethyl-2-(p-tolyl)cinchoninamide Formula: C31H31N3OS MolecularWeight: 493.66234

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=C(C(=NC4=C(C=C(C=C34)C)C)C5=CC=C(C=C5)C)C

Isomeric SMILES

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=C(C(=NC4=C(C=C(C=C34)C)C)C5=CC=C(C=C5)C)C

InChI

InChI=1S/C31H31N3OS/c1-6-21-9-12-23-25(16-32)31(36-26(23)15-21)34-30(35)27-20(5)29(22-10-7-17(2)8-11-22)33-28-19(4)13-18(3)14-24(27)28/h7-8,10-11,13-14,21H,6,9,12,15H2,1-5H3,(H,34,35)