(6Z)-3-benzylsulfanyl-5-imino-6-(thiophen-2-ylmethylidene)-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
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![(6Z)-3-benzylsulfanyl-5-imino-6-(thiophen-2-ylmethylidene)-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/79d9a6394bdc4a6c8fafc42cb49b6634.png "(6Z)-3-benzylsulfanyl-5-imino-6-(thiophen-2-ylmethylidene)-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one")
(6Z)-3-benzylsulfanyl-5-imino-6-(thiophen-2-ylmethylidene)-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
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CAS No:
1164463-15-3
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Formula:
C17H12N4OS3
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Chemical Name:
(6Z)-3-benzylsulfanyl-5-imino-6-(thiophen-2-ylmethylidene)-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one
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Synonyms:
MLS000577260;SMR000197369;3-(benzylthio)-5-imino-6-(2-thienylmethylene)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one;CHEMBL1518285;BDBM57447;cid_1994324;REGID_for_CID_1994324;HMS2417C23;ZINC4872545;STK862594;AKOS005609575;(6Z)-3-benzylsulfanyl-5-imino-6-(thiophen-2-ylmethylidene)-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one;(6Z)-3-(benzylthio)-5-imino-6-(2-thenylidene)-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one;(6Z)-3-(benzylsulfanyl)-5-imino-6-(thiophen-2-ylmethylidene)-5,6-dihydro-7H-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one;(6Z)-5-azanylidene-3-(phenylmethylsulfanyl)-6-(thiophen-2-ylmethylidene)-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one;(6Z)-5-imino-3-(phenylmethylthio)-6-(thiophen-2-ylmethylidene)-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one;1164463-15-3
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CAS No:
(6Z)-3-benzylsulfanyl-5-imino-6-(thiophen-2-ylmethylidene)-[1,2,4]thiadiazolo[4,5-a]pyrimidin-7-one Basic Attributes
384.5 g/mol
384.01732454 g/mol
Computed Properties
Molecular Weight:384.5
XLogP3:4
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:384.01732454
Monoisotopic Mass:384.01732454
Topological Polar Surface Area:148
Heavy Atom Count:25
Complexity:667
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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