5-ethoxy-1-methyl-3-methylsulfanyl-1-oxo-1λ6-thia-2-azacyclohexa-2,4,6-triene-4-carbonitrile
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5-ethoxy-1-methyl-3-methylsulfanyl-1-oxo-1λ6-thia-2-azacyclohexa-2,4,6-triene-4-carbonitrile
structure -
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CAS No:
65322-16-9
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Formula:
C9H12N2O2S2
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Chemical Name:
5-ethoxy-1-methyl-3-methylsulfanyl-1-oxo-1λ6-thia-2-azacyclohexa-2,4,6-triene-4-carbonitrile
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Synonyms:
NSC304444;65322-16-9;DTXSID50316542;NSC-304444
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CAS No:
5-ethoxy-1-methyl-3-methylsulfanyl-1-oxo-1λ6-thia-2-azacyclohexa-2,4,6-triene-4-carbonitrile Basic Attributes
244.3 g/mol
244.03401998 g/mol
304444
DTXSID50316542
Computed Properties
Molecular Weight:244.3
XLogP3:0.6
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:244.03401998
Monoisotopic Mass:244.03401998
Topological Polar Surface Area:96.1
Heavy Atom Count:15
Complexity:488
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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