(5E)-5-[[4-bromo-5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione
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![(5E)-5-[[4-bromo-5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/f36570e0334248499fd8052118e37bdc.png "(5E)-5-[[4-bromo-5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione")
(5E)-5-[[4-bromo-5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione
structure -
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CAS No:
445407-08-9
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Formula:
C16H10BrClN2O3S2
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Chemical Name:
(5E)-5-[[4-bromo-5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione
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Synonyms:
(5E)-5-({4-bromo-5-[(4-chlorophenyl)sulfanyl]furan-2-yl}methylidene)-1-methyl-2-thioxodihydropyrimidine-4,6(1H,5H)-dione;ZINC1273238;STK190073;STL041468;AKOS000328723;AKOS005695043;AM-879/40861451;(5E)-5-({4-bromo-5-[(4-chlorophenyl)sulfanyl]furan-2-yl}methylidene)-1-methyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione;445407-08-9;5-({4-bromo-5-[(4-chlorophenyl)sulfanyl]-2-furyl}methylene)-1-methyl-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
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CAS No:
(5E)-5-[[4-bromo-5-(4-chlorophenyl)sulfanylfuran-2-yl]methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione Basic Attributes
457.8 g/mol
455.90047 g/mol
Computed Properties
Molecular Weight:457.8
XLogP3:4.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:455.90047
Monoisotopic Mass:455.90047
Topological Polar Surface Area:120
Heavy Atom Count:25
Complexity:610
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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