N-(2,1,3-Benzoxadiazol-4-yl)-2-(propylsulfanyl)nicotinamide

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Systematic / IUPAC Name: N-(2,1,3-Benzoxadiazol-4-yl)-2-(propylsulfanyl)nicotinamide

ID: Reference3812

Other Names: N-(2,1,3-Benzoxadiazol-4-yl)-2-(propylsulfanyl)pyridine-3-carboxamide;
3-Pyridinecarboxamide, N-2,1,3-benzoxadiazol-4-yl-2-(propylthio)-

Formula: C15H14N4O2S

Spectral Data

N-(2,1,3-Benzoxadiazol-4-yl)-2-(propylsulfanyl)nicotinamide 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 2
No. of Spectra 239
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 2/15/2016 7:57:47 AM
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Identificators

InChI InChI=1S/C15H14N4O2S/c1-2-9-22-15-10(5-4-8-16-15)14(20)17-11-6-3-7-12-13(11)19-21-18-12/h3-8H,2,9H2,1H3,(H,17,20)
InChI Key IFIJKWGUGCTPBY-UHFFFAOYSA-N
Canonical SMILES CCCSC1=C(C=CC=N1)C(=O)NC2=CC=CC3=NON=C32
CAS
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Other Names N-(2,1,3-Benzoxadiazol-4-yl)-2-(propylsulfanyl)pyridine-3-carboxamide;
3-Pyridinecarboxamide, N-2,1,3-benzoxadiazol-4-yl-2-(propylthio)-

In Other Databases

ChemSpider 2094217
PubChem 2815855