2,2-Diethyl-4-Oxo-4-[[3-[(E)-2-(4-Propan-2-Yl-1,3-Thiazol-2-Yl)Ethenyl]Phenyl]Amino]Butanoic Acid
[CAS# 140646-80-6]

Identification

• Name: 2,2-Diethyl-4-Oxo-4-[[3-[(E)-2-(4-Propan-2-Yl-1,3-Thiazol-2-Yl)Ethenyl]Phenyl]Amino]Butanoic Acid
• Synonyms: 2,2-Diethyl-4-[[3-[(E)-2-(4-Isopropylthiazol-2-Yl)Vinyl]Phenyl]Amino]-4-Oxo-Butanoic Acid; 2,2-Diethyl-4-[[3-[(E)-2-(4-Isopropyl-2-Thiazolyl)Vinyl]Phenyl]Amino]-4-Oxobutanoic Acid; 2,2-Diethyl-4-[[3-[(E)-2-(4-Isopropylthiazol-2-Yl)Vinyl]Phenyl]Amino]-4-Keto-Butyric Acid
• Molecular Formula: C₂₂H₂₈N₂O₃S
• Molecular Weight: 400.53
• CAS Registry Number: 140646-80-6
• SMILES: C2=C(/C=C/C1=NC(=CS1)C(C)C)C=CC=C2NC(=O)CC(C(=O)O)(CC)CC
• InChI: 1S/C22H28N2O3S/c1-5-22(6-2,21(26)27)13-19(25)23-17-9-7-8-16(12-17)10-11-20-24-18(14-28-20)15(3)4/h7-12,14-15H,5-6,13H2,1-4H3,(H,23,25)(H,26,27)/b11-10+
• InChIKey: PGLNVMJTDKEOBE-ZHACJKMWSA-N

Properties

• Density: 1.206g/cm³ (Cal.)