N-[4-(Dimethylamino)-3,5-difluorobenzoyl]-N'-(pyridin-3-ylmethyl)urea

Systematic / IUPAC Name: 4-(Dimethylamino)-3,5-difluoro-N-[(3-pyridinylmethyl)carbamoyl]benzamide

ID: Reference7118

Other Names: N-[4-(Dimethylamino)-3,5-difluorobenzoyl]-N'-(pyridin-3-ylmethyl)urea ;
3-{[4-(Dimethylamino)-3,5-difluorophenyl]carbonyl}-1-(pyridin-3-ylmethyl)urea;
4-(Dimethylamino)-3,5-difluoro-N-(pyridin-3-ylmethylcarbamoyl)benzamide;
Benzamide, 4-(dimethylamino)-3,5-difluoro-N-{[(3-pyridinylmethyl)amino]carbonyl}-

Formula: C16H16F2N4O2

Spectral Data

N-[4-(Dimethylamino)-3,5-difluorobenzoyl]-N'-(pyridin-3-ylmethyl)urea 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 238
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 12/1/2017 11:13:27 AM
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Identificators

InChI InChI=1S/C16H16F2N4O2/c1-22(2)14-12(17)6-11(7-13(14)18)15(23)21-16(24)20-9-10-4-3-5-19-8-10/h3-8H,9H2,1-2H3,(H2,20,21,23,24)
InChI Key BAQAIZDSTKHCIK-UHFFFAOYSA-N
Canonical SMILES CN(C)C1=C(C=C(C=C1F)C(=O)NC(=O)NCC2=CN=CC=C2)F
CAS
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Other Names N-[4-(Dimethylamino)-3,5-difluorobenzoyl]-N'-(pyridin-3-ylmethyl)urea ;
3-{[4-(Dimethylamino)-3,5-difluorophenyl]carbonyl}-1-(pyridin-3-ylmethyl)urea;
4-(Dimethylamino)-3,5-difluoro-N-(pyridin-3-ylmethylcarbamoyl)benzamide;
Benzamide, 4-(dimethylamino)-3,5-difluoro-N-{[(3-pyridinylmethyl)amino]carbonyl}-

In Other Databases

ChEMBL CHEMBL1372551
ChemSpider 2021329
PubChem 2739712