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

Systemtic Name: 7-chloranyl-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-methoxyphenyl)-8-methyl-quinoline-4-carboxamide Openeye Name: 7-chloro-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(4-methoxyphenyl)-8-methyl-quinoline-4-carboxamide CAS Name: 7-chloro-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-methoxyphenyl)-8-methyl-4-quinolinecarboxamide IUPAC Name: 7-chloro-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-2-(4-methoxyphenyl)-8-methylquinoline-4-carboxamide Traditional Name: 7-chloro-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-2-(4-methoxyphenyl)-8-methyl-cinchoninamide Formula: C29H26ClN3O2S MolecularWeight: 516.05364

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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)OC

Isomeric SMILES

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

InChI

InChI=1S/C29H26ClN3O2S/c1-4-17-5-10-20-23(15-31)29(36-26(20)13-17)33-28(34)22-14-25(18-6-8-19(35-3)9-7-18)32-27-16(2)24(30)12-11-21(22)27/h6-9,11-12,14,17H,4-5,10,13H2,1-3H3,(H,33,34)