Sodium (4S)-2-(6-Ethoxy-1,3-Benzothiazol-2-Yl)-4,5-Dihydro-1,3-Thiazole-4-Carboxylate
[CAS# 103404-64-4]

Identification

• Name: Sodium (4S)-2-(6-Ethoxy-1,3-Benzothiazol-2-Yl)-4,5-Dihydro-1,3-Thiazole-4-Carboxylate
• Synonyms: 4,5-Dihydro-2-(6-ethoxy-2-benzothiazolyl)-4-thiazolinecarboxylic acid sodium salt; 6′-O-Ethylluciferin sodium salt; Luciferin 6′-ethyl ether sodium salt
• Molecular Formula: C₁₃H₁₁N₂NaO₃S₂
• Molecular Weight: 330.36
• CAS Registry Number: 103404-64-4
• SMILES: [Na+].O=C([O-])[C@@H]1/N=C(\SC1)c2sc3cc(OCC)ccc3n2
• InChI: 1S/C13H12N2O3S2.Na/c1-2-18-7-3-4-8-10(5-7)20-12(14-8)11-15-9(6-19-11)13(16)17;/h3-5,9H,2,6H2,1H3,(H,16,17);/q;+1/p-1/t9-;/m1./s1
• InChIKey: PYKJITLAHMFBSA-SBSPUUFOSA-M

Properties

• Refractive index: (Cal.)