N-(2,6-dimethylphenyl)-2-(4-oxidanyl-3,5-diphenyl-phenyl)sulfanyl-pentanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-(4-oxidanyl-3,5-diphenyl-phenyl)sulfanyl-pentanamide Openeye Name: N-(2,6-dimethylphenyl)-2-(4-hydroxy-3,5-diphenyl-phenyl)sulfanyl-pentanamide CAS Name: N-(2,6-dimethylphenyl)-2-[(4-hydroxy-3,5-diphenylphenyl)thio]pentanamide IUPAC Name: N-(2,6-dimethylphenyl)-2-(4-hydroxy-3,5-diphenylphenyl)sulfanylpentanamide Traditional Name: N-(2,6-dimethylphenyl)-2-[(4-hydroxy-3,5-diphenyl-phenyl)thio]valeramide Formula: C31H31NO2S MolecularWeight: 481.64834

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NC1=C(C=CC=C1C)C)SC2=CC(=C(C(=C2)C3=CC=CC=C3)O)C4=CC=CC=C4

Isomeric SMILES

CCCC(C(=O)NC1=C(C=CC=C1C)C)SC2=CC(=C(C(=C2)C3=CC=CC=C3)O)C4=CC=CC=C4

InChI

InChI=1S/C31H31NO2S/c1-4-12-28(31(34)32-29-21(2)13-11-14-22(29)3)35-25-19-26(23-15-7-5-8-16-23)30(33)27(20-25)24-17-9-6-10-18-24/h5-11,13-20,28,33H,4,12H2,1-3H3,(H,32,34)