2-(3,5-Dimethyl-1H-pyrazol-1-yl)-4-(2-furyl)-6-(methylthio)pyrimidine-5-carbonitrile

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Systematic / IUPAC Name: 2-(3,5-Dimethyl-1H-pyrazol-1-yl)-4-(2-furyl)-6-(methylsulfanyl)-5-pyrimidinecarbonitrile

ID: Reference5614

Other Names: 5-Pyrimidinecarbonitrile, 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-(2-furanyl)-6-(methylthio)-

Formula: C15H13N5OS

Spectral Data

2-(3,5-Dimethyl-1H-pyrazol-1-yl)-4-(2-furyl)-6-(methylthio)pyrimidine-5-carbonitrile 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 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 9/14/2016 8:02:43 AM
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Identificators

InChI InChI=1S/C15H13N5OS/c1-9-7-10(2)20(19-9)15-17-13(12-5-4-6-21-12)11(8-16)14(18-15)22-3/h4-7H,1-3H3
InChI Key XIYOSRGHFGTBOS-UHFFFAOYSA-N
Canonical SMILES CC1=CC(=NN1C2=NC(=C(C(=N2)SC)C#N)C3=CC=CO3)C
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Other Names 5-Pyrimidinecarbonitrile, 2-(3,5-dimethyl-1H-pyrazol-1-yl)-4-(2-furanyl)-6-(methylthio)-

In Other Databases

PubChem 2821064
ChemSpider 2099292