1,3-Diethyl 2-[[[2-(methylthio)-5-thiazolyl]amino]methylene]propanedioate

Base Information

• Chemical Name: 1,3-Diethyl 2-[[[2-(methylthio)-5-thiazolyl]amino]methylene]propanedioate
• CAS No.: 91478-69-2
• Molecular Formula: C₁₂H₁₆N₂O₄S₂
• Molecular Weight: 316.402
• DSSTox Substance ID: DTXSID301147498

Synonyms:SCHEMBL18059275;DTXSID301147498;1,3-Diethyl 2-[[[2-(methylthio)-5-thiazolyl]amino]methylene]propanedioate;91478-69-2

Chemical Property of 1,3-Diethyl 2-[[[2-(methylthio)-5-thiazolyl]amino]methylene]propanedioate

Chemical Property:

• XLogP3: 3.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 9
• Exact Mass: 316.05514934
• Heavy Atom Count: 20
• Complexity: 357

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• Canonical SMILES: CCOC(=O)C(=CNC1=CN=C(S1)SC)C(=O)OCC

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