5-(2-Thienylmethylidene)hexahydropyrimidine-2,4,6-trione

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Systematic / IUPAC Name: 5-(2-Thienylmethylene)-2,4,6(1H,3H,5H)-pyrimidinetrione

ID: Reference5584

Other Names: 5-(2-Thienylmethylene)-1,3-dihydropyrimidine-2,4,6-trione;
5-(2-Thienylmethylene)pyrimidine-2,4,6(1H,3H,5H)-trione;
5-(Thiophen-2-ylmethylene)pyrimidine-2,4,6(1H,3H,5H)-trione;
5-(Thiophen-2-ylmethylidene)-1,3-diazinane-2,4,6-trione;
5-(Thiophen-2-ylmethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione

Formula: C9H6N2O3S

Spectral Data

5-(2-Thienylmethylidene)hexahydropyrimidine-2,4,6-trione mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 1
No. of Spectra 71
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 9/12/2016 1:17:51 PM
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Identificators

InChI InChI=1S/C9H6N2O3S/c12-7-6(4-5-2-1-3-15-5)8(13)11-9(14)10-7/h1-4H,(H2,10,11,12,13,14)
InChI Key VNCNRGORRVUAOZ-UHFFFAOYSA-N
Canonical SMILES C1=CSC(=C1)C=C2C(=O)NC(=O)NC2=O
CAS
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Other Names 5-(2-Thienylmethylene)-1,3-dihydropyrimidine-2,4,6-trione;
5-(2-Thienylmethylene)pyrimidine-2,4,6(1H,3H,5H)-trione;
5-(Thiophen-2-ylmethylene)pyrimidine-2,4,6(1H,3H,5H)-trione;
5-(Thiophen-2-ylmethylidene)-1,3-diazinane-2,4,6-trione;
5-(Thiophen-2-ylmethylidene)pyrimidine-2,4,6(1H,3H,5H)-trione

In Other Databases

ChEMBL CHEMBL1871588
ChemSpider 230432
PubChem 262395