Sodium 5-[(3-Ethyl-3H-Benzoxazol-2-Ylidene)Ethylidene]-4-Oxo-3-Phenyl-2-Thioxoimidazolidine-1-Acetate
[CAS# 68239-69-0]

Identification

• Name: Sodium 5-[(3-Ethyl-3H-Benzoxazol-2-Ylidene)Ethylidene]-4-Oxo-3-Phenyl-2-Thioxoimidazolidine-1-Acetate
• Synonyms: Sodium 2-[(5Z)-5-[(2E)-2-(3-Ethyl-1,3-Benzoxazol-2-Ylidene)Ethylidene]-4-Oxo-3-Phenyl-2-Thioxo-Imidazolidin-1-Yl]Acetate; Sodium 2-[(5Z)-5-[(2E)-2-(3-Ethyl-1,3-Benzoxazol-2-Ylidene)Ethylidene]-4-Oxo-3-Phenyl-2-Thioxo-1-Imidazolidinyl]Acetate; Sodium 2-[(5Z)-5-[(2E)-2-(3-Ethyl-1,3-Benzoxazol-2-Ylidene)Ethylidene]-4-Keto-3-Phenyl-2-Thioxo-Imidazolidin-1-Yl]Acetate
• Molecular Formula: C₂₂H₁₈N₃NaO₄S
• Molecular Weight: 443.45
• CAS Registry Number: 68239-69-0
• EINECS: 269-462-0
• SMILES: C4=C(N1C(=O)\C(N(C1=S)CC([O-])=O)=C\C=C3\OC2=CC=CC=C2N3CC)C=CC=C4.[Na+]
• InChI: 1S/C22H19N3O4S.Na/c1-2-23-16-10-6-7-11-18(16)29-19(23)13-12-17-21(28)25(15-8-4-3-5-9-15)22(30)24(17)14-20(26)27;/h3-13H,2,14H2,1H3,(H,26,27);/q;+1/p-1/b17-12-,19-13+
• InChIKey: ZQPVEFYHGQHTCB-BVIIKHADSA-M

Properties

• Boiling point: 531.7°C at 760 mmHg (Cal.)
• Flash point: 275.4°C (Cal.)