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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C(=C3C=C(C=CC3=N2)Cl)C(=O)NC4=C(C5=C(S4)CCCC5)C#N)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C(=C3C=C(C=CC3=N2)Cl)C(=O)NC4=C(C5=C(S4)CCCC5)C#N)C

InChI

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