5,6-dimethyl-2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one
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![5,6-dimethyl-2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/53f439dd645843639422c716671abf1b.png "5,6-dimethyl-2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one")
5,6-dimethyl-2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one
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CAS No:
637326-96-6
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Formula:
C17H15N5OS3
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Chemical Name:
5,6-dimethyl-2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one
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Synonyms:
5,6-dimethyl-2-(((4-phenyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl)thio)thieno[2,3-d]pyrimidin-4(3H)-one;637326-96-6;5,6-dimethyl-2-[(4-phenyl-5-thioxo(1,2,4-triazolin-3-yl))methylthio]-3-hydroth iopheno[2,3-d]pyrimidin-4-one;5,6-dimethyl-2-{[(4-phenyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl]thio}thieno[2,3-d]pyrimidin-4(3H)-one;CBKinase1_007882;CBKinase1_020282;ZINC2671301;SBB083852;STL079712;AKOS002067324;MCULE-6642264645;5,6-dimethyl-2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one;ST50080515;BRD-K30001647-001-01-4;F1598-0007;5,6-dimethyl-2-{[(4-phenyl-5-thioxo-4,5-dihydro-1H-1,2,4-triazol-3-yl)methyl]sulfanyl}thieno[2,3-d]pyrimidin-4(3H)-one
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CAS No:
5,6-dimethyl-2-[(4-phenyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one Basic Attributes
401.5 g/mol
401.04387364 g/mol
Computed Properties
Molecular Weight:401.5
XLogP3:3.8
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:401.04387364
Monoisotopic Mass:401.04387364
Topological Polar Surface Area:155
Heavy Atom Count:26
Complexity:661
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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