2-((2-methoxyphenoxy)methyl)-beta-oxo-N-(3-pyridinylmethyl)-3-Thiazolidinepropanamide (E)-2-butenedioate (2:1)
[CAS# 161364-76-7]

Identification

• Name: 2-((2-methoxyphenoxy)methyl)-beta-oxo-N-(3-pyridinylmethyl)-3-Thiazolidinepropanamide (E)-2-butenedioate (2:1)
• Synonyms: 3-[2-[(2-Methoxyphenoxy)Methyl]Thiazolidin-3-Yl]-3-Oxo-N-(3-Pyridylmethyl)Propanamide; 3-[2-[(2-Methoxyphenoxy)Methyl]Thiazolidin-3-Yl]-3-Oxo-N-(3-Pyridylmethyl)Propanamide; Succinic Acid; 3-[2-[(2-Methoxyphenoxy)Methyl]-3-Thiazolidinyl]-3-Oxo-N-(3-Pyridylmethyl)Propanamide; 3-[2-[(2-Methoxyphenoxy)Methyl]-3-Thiazolidinyl]-3-Oxo-N-(3-Pyridylmethyl)Propanamide; Succinic Acid
• Molecular Formula: C₄₄H₅₂N₆O₁₂S₂
• Molecular Weight: 921.05
• CAS Registry Number: 161364-76-7
• SMILES: C3=C(OCC1SCCN1C(=O)CC(=O)NCC2=CC=CN=C2)C(=CC=C3)OC.C6=C(OCC4SCCN4C(=O)CC(=O)NCC5=CC=CN=C5)C(=CC=C6)OC.C(C(=O)O)CC(=O)O
• InChI: 1S/2C20H23N3O4S.C4H6O4/c2*1-26-16-6-2-3-7-17(16)27-14-20-23(9-10-28-20)19(25)11-18(24)22-13-15-5-4-8-21-12-15;5-3(6)1-2-4(7)8/h2*2-8,12,20H,9-11,13-14H2,1H3,(H,22,24);1-2H2,(H,5,6)(H,7,8)
• InChIKey: CSIHCFMAQOSRMH-UHFFFAOYSA-N

Properties

• Boiling point: 688.4°C at 760 mmHg (Cal.)
• Flash point: 370.1°C (Cal.)