N1-(4-Nitrophenyl)-2-amino-3-(benzylthio)propanamide

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Systematic / IUPAC Name: S-Benzyl-N-(4-nitrophenyl)cysteinamide

ID: Reference6817

Other Names: 2-Amino-3-(benzylsulfanyl)-N-(4-nitrophenyl)propanamide;
Propanamide, 2-amino-N-(4-nitrophenyl)-3-[(phenylmethyl)thio]-

Formula: C16H17N3O3S

Spectral Data

N1-(4-Nitrophenyl)-2-amino-3-(benzylthio)propanamide 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 236
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 9/13/2017 1:01:13 PM
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Identificators

InChI InChI=1S/C16H17N3O3S/c17-15(11-23-10-12-4-2-1-3-5-12)16(20)18-13-6-8-14(9-7-13)19(21)22/h1-9,15H,10-11,17H2,(H,18,20)
InChI Key HOZQMLJHNCMSRC-UHFFFAOYSA-N
Canonical SMILES
CAS
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Other Names 2-Amino-3-(benzylsulfanyl)-N-(4-nitrophenyl)propanamide;
Propanamide, 2-amino-N-(4-nitrophenyl)-3-[(phenylmethyl)thio]-

In Other Databases

ChEMBL CHEMBL1864463
PubChem 100118
ChemIDPlus 052207075
ChemSpider 90474