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2-(5-{[(4Z)-9,11-dimethyl-3-oxo-5-thia-2,7-diazatricyclo[6.4.0.0²,⁶]dodeca-1(12),6,8,10-tetraen-4-ylidene]methyl}furan-2-yl)benzoic acid

2-(5-{[(4Z)-9,11-dimethyl-3-oxo-5-thia-2,7-diazatricyclo[6.4.0.0²,⁶]dodeca-1(12),6,8,10-tetraen-4-ylidene]methyl}furan-2-yl)benzoic acid
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Compound number:
MolPort-002-162-609
IUPAC:
2-(5-{[(4Z)-9,11-dimethyl-3-oxo-5-thia-2,7-diazatricyclo[6.4.0.0²,⁶]dodeca-1(12),6,8,10-tetraen-4-ylidene]methyl}furan-2-yl)benzoic acid
IUPAC traditional:
2-(5-{[(4Z)-9,11-dimethyl-3-oxo-5-thia-2,7-diazatricyclo[6.4.0.0²,⁶]dodeca-1(12),6,8,10-tetraen-4-ylidene]methyl}furan-2-yl)benzoic acid
SMILES:
Cc1cc(C)c2nc3s\c(=C/c4ccc(o4)-c4ccccc4C(O)=O)c(=O)n3c2c1
InChI key:
JFRYLPFKWKOMBZ-ODLFYWEKSA-N
Molecular formula:
C23H16N2O4S
Molecular weight: 416.45
Solubility: not available
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Supplier Catalogue Data


Catalog: Screening compound Ships out: 12 business days Purity: 90%
Last updated: > 3 months ago In warehouse: 25.00 mg
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5 micromol December 25, 2019 48.00 USD
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1 mg December 25, 2019 40.00 USD
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5 mg December 25, 2019 60.00 USD
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More Information

Compound Identifiers
Compound number: MolPort-002-162-609

Names, Synonyms and 3rd Party Identifiers
Name: ZINC000016676045
2-{5-[(6,8-dimethyl-3-oxo-1,3-thiazolidino[3,2-a]benzimidazol-2-ylidene)methyl ]-2-furyl}benzoic acid
2-{5-[(6,8-dimethyl-3-oxo[1,3]thiazolo[3,2-a]benzimidazol-2(3H)-ylidene)methyl]-2-furyl}benzoic acid

InChI
InChI: 1S/C23H16N2O4S/c1-12-9-13(2)20-17(10-12)25-21(26)19(30-23(25)24-20)11-14-7-8-18(29-14)15-5-3-4-6-16(15)22(27)28/h3-11H,1-2H3,(H,27,28)/b19-11-
InChI key: JFRYLPFKWKOMBZ-ODLFYWEKSA-N

Calculated Properties
Molecular formula: C23H16N2O4S
Molecular weight: 416.45

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2019 MolPort, v3.28, release date 17-11-2019 13:00 (+0200). All rights reserved.
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