1-(5-Anilino-1,2,4-thiadiazol-3-yl)acetone

enlarge

Systematic / IUPAC Name: 1-(5-Anilino-1,2,4-thiadiazol-3-yl)acetone

ID: Reference5276

Other Names: 1-(5-(Phenylamino)-1,2,4-thiadiazol-3-yl)propan-2-one;
1-(5-Anilino-1,2,4-thiadiazol-3-yl)propan-2-one;
1-[5-(Phenylamino)-1,2,4-thiadiazol-3-yl]propan-2-one;
2-Propanone, 1-[5-(phenylamino)-1,2,4-thiadiazol-3-yl]-

Formula: C11H11N3OS

Spectral Data

1-(5-Anilino-1,2,4-thiadiazol-3-yl)acetone mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Q Exactive Orbitrap
No. of Spectral Trees 2
No. of Spectra 233
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 7/26/2016 11:30:49 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C11H11N3OS/c1-8(15)7-10-13-11(16-14-10)12-9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,12,13,14)
InChI Key XLJGKAGJWBNCSQ-UHFFFAOYSA-N
Canonical SMILES CC(=O)CC1=NSC(=N1)NC2=CC=CC=C2
CAS 64822000
Splash
Other Names 1-(5-(Phenylamino)-1,2,4-thiadiazol-3-yl)propan-2-one;
1-(5-Anilino-1,2,4-thiadiazol-3-yl)propan-2-one;
1-[5-(Phenylamino)-1,2,4-thiadiazol-3-yl]propan-2-one;
2-Propanone, 1-[5-(phenylamino)-1,2,4-thiadiazol-3-yl]-

In Other Databases

ChEMBL CHEMBL1573623
ChemSpider 2021314
PubChem 2739696