6-(3-chlorophenyl)-4-oxo-2-sulfanylidene-1H-pyrimidine-5-carbonitrile
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6-(3-chlorophenyl)-4-oxo-2-sulfanylidene-1H-pyrimidine-5-carbonitrile
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CAS No:
128640-94-8
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Formula:
C11H6ClN3OS
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Chemical Name:
6-(3-chlorophenyl)-4-oxo-2-sulfanylidene-1H-pyrimidine-5-carbonitrile
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Synonyms:
4-(3-chlorophenyl)-6-hydroxy-2-sulfanylpyrimidine-5-carbonitrile;MLS000762396;TQR961;CHEMBL1471522;HMS2757E12;ZINC6804533;MFCD00999378;SBB041876;STK235082;AKOS000270201;MCULE-3428393230;SMR000415988;ST50215564;4-(3-Chloro-phenyl)-6-hydroxy-2-mercapto-pyrimidine-5-carbonitrile;4-(3-chlorophenyl)-6-hydroxy-2-sulfanyl-5-pyrimidinecarbonitrile;2-Thioxo-4-oxo-6-(3-chlorophenyl)-1,2,3,4-tetrahydropyrimidine-5-carbonitrile;6-(3-chlorophenyl)-4-oxo-2-thioxo-1,2,3,4-tetrahydropyrimidine-5-carbonitrile;128640-94-8
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CAS No:
6-(3-chlorophenyl)-4-oxo-2-sulfanylidene-1H-pyrimidine-5-carbonitrile Basic Attributes
263.70 g/mol
262.9920107 g/mol
Computed Properties
Molecular Weight:263.70
XLogP3:1.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:262.9920107
Monoisotopic Mass:262.9920107
Topological Polar Surface Area:97
Heavy Atom Count:17
Complexity:451
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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