Sodium 1-Amino-4-(1,3-Benzothiazol-2-Ylsulfanyl)-9,10-Dioxoanthracene-2-Sulfonate
[CAS# 3767-77-9]

Identification

• Name: Sodium 1-Amino-4-(1,3-Benzothiazol-2-Ylsulfanyl)-9,10-Dioxoanthracene-2-Sulfonate
• Synonyms: Sodium 1-Amino-4-(1,3-Benzothiazol-2-Ylsulfanyl)-9,10-Dioxo-Anthracene-2-Sulfonate; Sodium 1-Amino-4-(1,3-Benzothiazol-2-Ylthio)-9,10-Dioxo-2-Anthracenesulfonate; Sodium 1-Amino-4-(1,3-Benzothiazol-2-Ylthio)-9,10-Diketo-Anthracene-2-Sulfonate
• Molecular Formula: C₂₁H₁₁N₂NaO₅S₃
• Molecular Weight: 490.50
• CAS Registry Number: 3767-77-9
• EINECS: 223-193-5
• SMILES: C1=C([S]([O-])(=O)=O)C(=C4C(=C1SC3=NC2=CC=CC=C2S3)C(=O)C5=C(C4=O)C=CC=C5)N.[Na+]
• InChI: 1S/C21H12N2O5S3.Na/c22-18-15(31(26,27)28)9-14(30-21-23-12-7-3-4-8-13(12)29-21)16-17(18)20(25)11-6-2-1-5-10(11)19(16)24;/h1-9H,22H2,(H,26,27,28);/q;+1/p-1
• InChIKey: FNJBWRQAUHSFIX-UHFFFAOYSA-M