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

Systemtic Name: 7-chloranyl-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-8-methyl-2-(4-propan-2-ylphenyl)quinoline-4-carboxamide Openeye Name: 7-chloro-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(4-isopropylphenyl)-8-methyl-quinoline-4-carboxamide CAS Name: 7-chloro-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-8-methyl-2-(4-propan-2-ylphenyl)-4-quinolinecarboxamide IUPAC Name: 7-chloro-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-8-methyl-2-(4-propan-2-ylphenyl)quinoline-4-carboxamide Traditional Name: 7-chloro-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-8-methyl-2-p-cumenyl-cinchoninamide Formula: C31H30ClN3OS MolecularWeight: 528.1074

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC(=NC4=C3C=CC(=C4C)Cl)C5=CC=C(C=C5)C(C)C

Isomeric SMILES

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC(=NC4=C3C=CC(=C4C)Cl)C5=CC=C(C=C5)C(C)C

InChI

InChI=1S/C31H30ClN3OS/c1-5-19-6-11-22-25(16-33)31(37-28(22)14-19)35-30(36)24-15-27(21-9-7-20(8-10-21)17(2)3)34-29-18(4)26(32)13-12-23(24)29/h7-10,12-13,15,17,19H,5-6,11,14H2,1-4H3,(H,35,36)