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Prop-2-en-1-yl 2-[(furan-2-yl)methylidene]-7-methyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

HCID 5208532
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Basic information

CAS
6997-65-5
Standard SMILES
C=CCOC(=O)C1=C(C)N=c2sc(=Cc3ccco3)c(=O)n2C1c1ccc(SC)cc1
InChIKey
WEYLEXDCOCAYKU-UHFFFAOYSA-N
Molecular formula
C23H20N2O4S2
Average molar mass
452.5 g/mol
Monoisotopic mass
452.08644947

Names & identifiers

Preferred name
Prop-2-en-1-yl 2-[(furan-2-yl)methylidene]-7-methyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
IUPAC
prop-2-enyl 2-(furan-2-ylmethylidene)-7-methyl-5-(4-methylsulfanylphenyl)-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Names & synonyms

6997-65-5DTXSID40410043Prop-2-en-1-yl 2-[(furan-2-yl)methylidene]-7-methyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Database identifiers

CAS
6997-65-5
PubChem CID
5208532
DTXSID
DTXSID40410043

Properties

Computed structural properties

XLogP
4.4
Topological polar surface area
123 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
7
Rotatable bonds
7
Heavy atoms
31
Formal charge
0
Complexity
843

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Compound notes

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