3-((4-CHLORO-2-(((PHENYLAMINO)THIOXOMETHYL)AMINO)PHENYL)AMINO)-5,5-DIMETHYLCYCLOHEX-2-EN-1-ONE
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3-((4-CHLORO-2-(((PHENYLAMINO)THIOXOMETHYL)AMINO)PHENYL)AMINO)-5,5-DIMETHYLCYCLOHEX-2-EN-1-ONE
structure -
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CAS No:
1022095-18-6
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Formula:
C21H22ClN3OS
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Chemical Name:
3-((4-CHLORO-2-(((PHENYLAMINO)THIOXOMETHYL)AMINO)PHENYL)AMINO)-5,5-DIMETHYLCYCLOHEX-2-EN-1-ONE
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Synonyms:
3-((4-CHLORO-2-(((PHENYLAMINO)THIOXOMETHYL)AMINO)PHENYL)AMINO)-5,5-DIMETHYLCYCLOHEX-2-EN-1-ONE
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CAS No:
3-((4-CHLORO-2-(((PHENYLAMINO)THIOXOMETHYL)AMINO)PHENYL)AMINO)-5,5-DIMETHYLCYCLOHEX-2-EN-1-ONE Basic Attributes
399.94
399.117
Computed Properties
Molecular Weight:399.9
XLogP3:4.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:4
Exact Mass:399.1172112
Monoisotopic Mass:399.1172112
Topological Polar Surface Area:85.2
Heavy Atom Count:27
Complexity:586
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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