sodium 3-[2-[2-[3-(2-hydroxyethyl)-5-oxo-1-phenyl-2-thioxo-imidazolidin-4-ylidene]ethylidene]-1,3-benzoxazol-3-yl]propyl hydrogen sulfate
[CAS# 95046-25-6]

Identification

• Name: sodium 3-[2-[2-[3-(2-hydroxyethyl)-5-oxo-1-phenyl-2-thioxo-imidazolidin-4-ylidene]ethylidene]-1,3-benzoxazol-3-yl]propyl hydrogen sulfate
• Synonyms: 1-(2-hydroxyethyl)-3-phenyl-2-thioxo-5-[[3-[3-(sulphooxy)propyl]-3H-benzoxazol-2-ylidene]ethylidene]imidazolidin-4-one, monosodium salt
• Molecular Formula: C₂₃H₂₃N₃NaO₇S₂
• Molecular Weight: 540.56
• CAS Registry Number: 95046-25-6
• EINECS: 305-813-7
• SMILES: [Na+].OS(=O)(=O)OCCCN3c4ccccc4OC3=CC=C2C(=O)N(c1ccccc1)C(=S)N2CCO
• InChI: 1S/C23H23N3O7S2.Na/c27-15-14-25-19(22(28)26(23(25)34)17-7-2-1-3-8-17)11-12-21-24(13-6-16-32-35(29,30)31)18-9-4-5-10-20(18)33-21;/h1-5,7-12,27H,6,13-16H2,(H,29,30,31);/q;+1
• InChIKey: MTCWCQWVPAJEJF-UHFFFAOYSA-N