(5Z)-1-(4-methylphenyl)-5-[(1-methylpyrrol-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
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(5Z)-1-(4-methylphenyl)-5-[(1-methylpyrrol-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
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CAS No:
346643-72-9
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Formula:
C17H15N3O2S
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Chemical Name:
(5Z)-1-(4-methylphenyl)-5-[(1-methylpyrrol-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
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Synonyms:
ZINC4823021;STK846795;AKOS005627467;AKOS030509908;AB00098042-01;SR-01000220992;SR-01000220992-1;(5Z)-1-(4-methylphenyl)-5-[(1-methyl-1H-pyrrol-2-yl)methylidene]-2-sulfanylpyrimidine-4,6(1H,5H)-dione;(Z)-5-((1-methyl-1H-pyrrol-2-yl)methylene)-2-thioxo-1-(p-tolyl)dihydropyrimidine-4,6(1H,5H)-dione;346643-72-9
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CAS No:
(5Z)-1-(4-methylphenyl)-5-[(1-methylpyrrol-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione Basic Attributes
325.4 g/mol
325.08849790 g/mol
Computed Properties
Molecular Weight:325.4
XLogP3:2.4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:325.08849790
Monoisotopic Mass:325.08849790
Topological Polar Surface Area:86.4
Heavy Atom Count:23
Complexity:552
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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