2-[(2-Amino-3,3-dicyano-2-propenyl)sulfanyl]-1-pyridiniumolate

Base Information

• Chemical Name: 2-[(2-Amino-3,3-dicyano-2-propenyl)sulfanyl]-1-pyridiniumolate
• CAS No.: 338778-97-5
• Molecular Formula: C10H8N4OS
• Molecular Weight: 232.26
• ChEMBL ID: CHEMBL1312315
• Mol file: 338778-97-5.mol

Synonyms:338778-97-5;2-[(2-amino-3,3-dicyano-2-propenyl)sulfanyl]-1-pyridiniumolate;2-[(2-amino-3,3-dicyanoprop-2-en-1-yl)sulfanyl]pyridin-1-ium-1-olate;2-[1-amino-2-(1-oxidopyridin-1-ium-2-yl)sulfanylethylidene]propanedinitrile;2-((2-amino-3,3-dicyano-2-propenyl)sulfanyl)-1-pyridiniumolate;MLS000694843;CHEMBL1312315;HMS2646C17;MFCD00139197;AKOS005096964;SMR000333161;6C-088;2-(2-amino-3,3-dicyanoallylthio)pyridine 1-oxide;2-[(2-Amino-3,3-dicyano-2-propenyl)sulfanyl]-1- pyridiniumolate

Chemical Property of 2-[(2-Amino-3,3-dicyano-2-propenyl)sulfanyl]-1-pyridiniumolate

Chemical Property:

• XLogP3: -0.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 232.04188206
• Heavy Atom Count: 16
• Complexity: 357

Purity/Quality:

95%-98% ^*data from raw suppliers

2-[(2-Amino-3,3-dicyano-2-propenyl)sulfanyl]-1-pyridiniumolate ^*data from reagent suppliers

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: C1=CC=[N+](C(=C1)SCC(=C(C#N)C#N)N)[O-]

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