Synalgos
[CAS# 79102-58-2]

Identification

• Name: Synalgos
• Synonyms: 2-Acetoxybenzoic Acid; N,N-Dimethyl-1-Phenothiazin-10-Yl-Propan-2-Amine; N-(4-Ethoxyphenyl)Acetamide; 1,3,7-Trimethylpurine-2,6-Dione; Hydrochloride; 2-Acetoxybenzoic Acid
• Molecular Formula: C₄₄H₅₂ClN₇O₈S
• Molecular Weight: 874.45
• CAS Registry Number: 79102-58-2
• SMILES: N(C1=CC=C(OCC)C=C1)C(=O)C.C4=C3N(CC(N(C)C)C)C2=CC=CC=C2SC3=CC=C4.C5=NC6=C([N]5C)C(=O)N(C(=O)N6C)C.[Cl-].O=C(O)C7=CC=CC=C7OC(=O)C
• InChI: 1S/C17H20N2S.C10H13NO2.C9H8O4.C8H10N4O2.ClH/c1-13(18(2)3)12-19-14-8-4-6-10-16(14)20-17-11-7-5-9-15(17)19;1-3-13-10-6-4-9(5-7-10)11-8(2)12;1-6(10)13-8-5-3-2-4-7(8)9(11)12;1-10-4-9-6-5(10)7(13)12(3)8(14)11(6)2;/h4-11,13H,12H2,1-3H3;4-7H,3H2,1-2H3,(H,11,12);2-5H,1H3,(H,11,12);4H,1-3H3;1H
• InChIKey: ZGWVKGYYNSULOV-UHFFFAOYSA-N