N1-Phenethyl-2-[3-(4-hydroxyphenyl)propanoyl]hydrazine-1-carbothioamide

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Systematic / IUPAC Name: 2-[3-(4-Hydroxyphenyl)propanoyl]-N-(2-phenylethyl)hydrazinecarbothioamide

ID: Reference5921

Other Names: 1-[3-(4-Hydroxyphenyl)propanoylamino]-3-phenethylthiourea;
Benzenepropanoic acid, 4-hydroxy, 2-{[(2-phenylethyl)amino]thioxomethyl}hydrazide

Formula: C18H21N3O2S

Spectral Data

N1-Phenethyl-2-[3-(4-hydroxyphenyl)propanoyl]hydrazine-1-carbothioamide 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 117
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 11/8/2016 10:19:30 AM
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Identificators

InChI InChI=1S/C18H21N3O2S/c22-16-9-6-15(7-10-16)8-11-17(23)20-21-18(24)19-13-12-14-4-2-1-3-5-14/h1-7,9-10,22H,8,11-13H2,(H,20,23)(H2,19,21,24)
InChI Key PZPUEZPDYZUHBT-UHFFFAOYSA-N
Canonical SMILES C1=CC=C(C=C1)CCNC(=S)NNC(=O)CCC2=CC=C(C=C2)O
CAS
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Other Names 1-[3-(4-Hydroxyphenyl)propanoylamino]-3-phenethylthiourea;
Benzenepropanoic acid, 4-hydroxy, 2-{[(2-phenylethyl)amino]thioxomethyl}hydrazide

In Other Databases

ChemSpider 2076095
ChEMBL CHEMBL1543118
PubChem 2797288