N-[4-[2,4-Bis(2-Methylbutan-2-Yl)Phenoxy]Butyl]-1-Hydroxy-4-(1-Phenyltetrazol-5-Yl)Sulfanyl-Naphthalene-2-Carboxamide
[CAS# 5084-12-8]

Identification

• Name: N-[4-[2,4-Bis(2-Methylbutan-2-Yl)Phenoxy]Butyl]-1-Hydroxy-4-(1-Phenyltetrazol-5-Yl)Sulfanyl-Naphthalene-2-Carboxamide
• Synonyms: N-[4-[2,4-Bis(1,1-Dimethylpropyl)Phenoxy]Butyl]-1-Hydroxy-4-(1-Phenyltetrazol-5-Yl)Sulfanyl-Naphthalene-2-Carboxamide; N-[4-[2,4-Bis(1,1-Dimethylpropyl)Phenoxy]Butyl]-1-Hydroxy-4-[(1-Phenyl-5-Tetrazolyl)Thio]-2-Naphthalenecarboxamide; N-[4-(2,4-Ditert-Amylphenoxy)Butyl]-1-Hydroxy-4-[(1-Phenyltetrazol-5-Yl)Thio]-2-Naphthamide
• Molecular Formula: C₃₈H₄₅N₅O₃S
• Molecular Weight: 651.87
• CAS Registry Number: 5084-12-8
• EINECS: 225-796-9
• SMILES: C3=C(SC1=NN=N[N]1C2=CC=CC=C2)C5=C(C(=C3C(NCCCCOC4=C(C(CC)(C)C)C=C(C=C4)C(CC)(C)C)=O)O)C=CC=C5
• InChI: 1S/C38H45N5O3S/c1-7-37(3,4)26-20-21-32(31(24-26)38(5,6)8-2)46-23-15-14-22-39-35(45)30-25-33(28-18-12-13-19-29(28)34(30)44)47-36-40-41-42-43(36)27-16-10-9-11-17-27/h9-13,16-21,24-25,44H,7-8,14-15,22-23H2,1-6H3,(H,39,45)
• InChIKey: CFRUNFQXALDGBM-UHFFFAOYSA-N

Properties

• Density: 1.183g/cm³ (Cal.)