2-[3-[(Z)-(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]indol-1-yl]-N-phenylacetamide

Base Information

• Chemical Name: 2-[3-[(Z)-(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]indol-1-yl]-N-phenylacetamide
• CAS No.: 6061-19-4
• Molecular Formula: C20H16N4O2S
• Molecular Weight: 376.4316
• DSSTox Substance ID: DTXSID40367427
• Wikidata: Q82153263

Synonyms:6061-19-4;AC1M4SN8;DTXSID40367427;BIM-0043340.P001;SR-01000226530;SR-01000226530-1

Chemical Property of 2-[3-[(Z)-(5-oxo-2-sulfanylideneimidazolidin-4-ylidene)methyl]indol-1-yl]-N-phenylacetamide

Chemical Property:

• Density: 1.4g/cm³
• XLogP3: 2.8
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 376.09939694
• Heavy Atom Count: 27
• Complexity: 644

Purity/Quality:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)NC(=O)CN2C=C(C3=CC=CC=C32)C=C4C(=O)NC(=S)N4
• Isomeric SMILES: C1=CC=C(C=C1)NC(=O)CN2C=C(C3=CC=CC=C32)/C=C\4/C(=O)NC(=S)N4

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