Acetyldipeptide A2
[CAS# 81645-12-7]

Identification

• Name: Acetyldipeptide A2
• Synonyms: 3-[[2-[2-(2-Acetamidoethyl)Thiazol-4-Yl]Thiazole-4-Carbonyl]Amino]Propyl-Dimethyl-Sulfonium Chloride; 3-[[[2-[2-(2-Acetamidoethyl)-4-Thiazolyl]-4-Thiazolyl]-Oxomethyl]Amino]Propyl-Dimethylsulfonium Chloride; 3-[[2-[2-(2-Acetamidoethyl)-1,3-Thiazol-4-Yl]-1,3-Thiazol-4-Yl]Carbonylamino]Propyl-Dimethyl-Sulfanium Chloride
• Molecular Formula: C₁₆H₂₃ClN₄O₂S₃
• Molecular Weight: 435.02
• CAS Registry Number: 81645-12-7
• SMILES: C1=C(C(NCCC[S+](C)C)=O)N=C(S1)C2=CSC(=N2)CCNC(=O)C.[Cl-]
• InChI: 1S/C16H22N4O2S3.ClH/c1-11(21)17-7-5-14-19-13(10-23-14)16-20-12(9-24-16)15(22)18-6-4-8-25(2)3;/h9-10H,4-8H2,1-3H3,(H-,17,18,21,22);1H
• InChIKey: TYOQVVVKESCAOH-UHFFFAOYSA-N