5-(1-benzothiophen-2-yl)-3-tert-butyl-N-(2-chloranyl-4-cyano-phenyl)-2-oxidanyl-benzamide

Systemtic Name: 5-(1-benzothiophen-2-yl)-3-tert-butyl-N-(2-chloranyl-4-cyano-phenyl)-2-oxidanyl-benzamide Openeye Name: 5-(benzothiophen-2-yl)-3-tert-butyl-N-(2-chloro-4-cyano-phenyl)-2-hydroxy-benzamide CAS Name: 5-(1-benzothiophen-2-yl)-3-tert-butyl-N-(2-chloro-4-cyanophenyl)-2-hydroxybenzamide IUPAC Name: 5-(1-benzothiophen-2-yl)-3-tert-butyl-N-(2-chloro-4-cyanophenyl)-2-hydroxybenzamide Traditional Name: 5-(benzothiophen-2-yl)-3-tert-butyl-N-(2-chloro-4-cyano-phenyl)-2-hydroxy-benzamide Formula: C26H21ClN2O2S MolecularWeight: 460.97514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(=O)NC2=C(C=C(C=C2)C#N)Cl)C3=CC4=CC=CC=C4S3

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(=O)NC2=C(C=C(C=C2)C#N)Cl)C3=CC4=CC=CC=C4S3

InChI

InChI=1S/C26H21ClN2O2S/c1-26(2,3)19-12-17(23-13-16-6-4-5-7-22(16)32-23)11-18(24(19)30)25(31)29-21-9-8-15(14-28)10-20(21)27/h4-13,30H,1-3H3,(H,29,31)