4-(2-methylprop-2-en-1-yl)-5-{[2-oxo-2-(thiophen-2-yl)ethyl]sulfanyl}-8-thia-4,6-diazatricyclo[7.4.0.0²,⁷]trideca-1(9),2(7),5-trien-3-one



Compound number:
MolPort-001-991-107
CAS number: 505068-32-6
IUPAC:
4-(2-methylprop-2-en-1-yl)-5-{[2-oxo-2-(thiophen-2-yl)ethyl]sulfanyl}-8-thia-4,6-diazatricyclo[7.4.0.0²,⁷]trideca-1(9),2(7),5-trien-3-one
IUPAC traditional:
4-(2-methylprop-2-en-1-yl)-5-{[2-oxo-2-(thiophen-2-yl)ethyl]sulfanyl}-8-thia-4,6-diazatricyclo[7.4.0.0²,⁷]trideca-1(9),2(7),5-trien-3-one
SMILES:
CC(=C)Cn1c(SCC(=O)c2cccs2)nc2sc3CCCCc3c2c1=O
InChI key:
XAKJIQPEGSCYIP-UHFFFAOYSA-N
Molecular formula:
C20H20N2O2S3
Molecular weight: 416.57
Solubility: not available

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Price range: from to USD Pack size: from to mg
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Supplier Catalogue Data


Catalog: Screening compound Ships out: 10 business days Purity: 90%
Last updated: this week In warehouse: 100.00 mg Salt: FREE
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5 micromol October 9, 2020 48.00 USD
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1 mg October 9, 2020 40.00 USD
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5 mg October 9, 2020 60.00 USD
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Catalog: Screening compound Ships out: 5 business days Purity: > 98%
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10 mg October 2, 2020 154.88 USD
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50 mg October 2, 2020 607.42 USD
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Catalog: Screening compound Ships out: 20 business days Purity: >=95%
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1 mg October 23, 2020 99.22 USD
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5 mg October 23, 2020 444.07 USD
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10 mg October 23, 2020 786.50 USD
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Catalog: Building blocks Ships out: 2 business days Purity: >95%
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10 mg September 29, 2020 175.00 USD
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50 mg September 29, 2020 585.00 USD
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100 mg September 29, 2020 990.00 USD
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Catalog: Building blocks Ships out: 2 business days Purity: 95%
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100 mg September 29, 2020 3603.00 USD
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Catalog: Building blocks Ships out: 7 business days Purity: ≥95%
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1 mg October 6, 2020 109.00 USD
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5 mg October 6, 2020 362.00 USD
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10 mg October 6, 2020 614.00 USD
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More Information

Compound Identifiers
Compound number: MolPort-001-991-107
CAS number: 505068-32-6

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000000909640
MFCD03724094
3-(2-methyl-2-propen-1-yl)-2-{[2-oxo-2-(2-thienyl)ethyl]thio}-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
3-(2-methylprop-2-enyl)-2-(2-oxo-2-(2-thienyl)ethylthio)-3,5,6,7,8-pentahydrob enzo[b]thiopheno[2,3-d]pyrimidin-4-one
5,6,7,8-tetrahydro-3-(2-methyl-2-propen-1-yl)-2-[[2-oxo-2-(2-thienyl)ethyl]thio]-[1]benzothieno[2,3-d]pyrimidin-4(3H)-one
Eggmanone

InChI
InChI: 1S/C20H20N2O2S3/c1-12(2)10-22-19(24)17-13-6-3-4-7-15(13)27-18(17)21-20(22)26-11-14(23)16-8-5-9-25-16/h5,8-9H,1,3-4,6-7,10-11H2,2H3
InChI key: XAKJIQPEGSCYIP-UHFFFAOYSA-N

Calculated Properties
Molecular formula: C20H20N2O2S3
Molecular weight: 416.57

Other

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2020 MolPort, v3.91, release date 21-09-2020 17:00 (+0200). All rights reserved.
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