N-[3-[(1S)-1-[(6R)-2-Hydroxy-4-Oxo-6-(2-Phenylethyl)-6-Propyl-5H-Pyran-3-Yl]Propyl]Phenyl]-5-(Trifluoromethyl)Pyridine-2-Sulfonamide
[CAS# 174590-27-3]

Identification

• Name: N-[3-[(1S)-1-[(6R)-2-Hydroxy-4-Oxo-6-(2-Phenylethyl)-6-Propyl-5H-Pyran-3-Yl]Propyl]Phenyl]-5-(Trifluoromethyl)Pyridine-2-Sulfonamide
• Synonyms: N-[3-[(1S)-1-[(6R)-2-Hydroxy-4-Oxo-6-(2-Phenylethyl)-6-Propyl-5H-Pyran-3-Yl]Propyl]Phenyl]-5-(Trifluoromethyl)-2-Pyridinesulfonamide; N-[3-[(1S)-1-[(6R)-2-Hydroxy-4-Keto-6-(2-Phenylethyl)-6-Propyl-5H-Pyran-3-Yl]Propyl]Phenyl]-5-(Trifluoromethyl)Pyridine-2-Sulfonamide; (R-(R*,S*))-N-(3-(1-(5,6-Dihydro-4-Hydroxy-2-Oxo-6-(2-Phenylethyl)-6-Propyl-2H-Pyran-3-Yl)Propyl)Phenyl)-5-(Trifluoromethyl)-2-Pyridinesulfonamide
• Molecular Formula: C₃₁H₃₃F₃N₂O₅S
• Molecular Weight: 602.67
• CAS Registry Number: 174590-27-3
• SMILES: [C@]1(OC(=C(C(=O)C1)[C@@H](CC)C2=CC(=CC=C2)N[S](=O)(=O)C3=NC=C(C=C3)C(F)(F)F)O)(CCC4=CC=CC=C4)CCC
• InChI: 1S/C31H33F3N2O5S/c1-3-16-30(17-15-21-9-6-5-7-10-21)19-26(37)28(29(38)41-30)25(4-2)22-11-8-12-24(18-22)36-42(39,40)27-14-13-23(20-35-27)31(32,33)34/h5-14,18,20,25,36,38H,3-4,15-17,19H2,1-2H3/t25-,30+/m0/s1
• InChIKey: NZPXPXAGXYTROM-SETSBSEESA-N

Properties

• Density: 1.313g/cm³ (Cal.)
• Boiling point: 680.022°C at 760 mmHg (Cal.)
• Flash point: 365.064°C (Cal.)