Ethyl 2-(3-{[4-(4-methylphenyl)-1,3-thiazol-2-yl]methyl}-4-oxo-3,4-dihydrophthalazin-1-yl)acetate

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Systematic / IUPAC Name: Ethyl (3-{[4-(4-methylphenyl)-1,3-thiazol-2-yl]methyl}-4-oxo-3,4-dihydro-1-phthalazinyl)acetate

ID: Reference6839

Other Names: 1-Phthalazineacetic acid, 3,4-dihydro-3-{[4-(4-methylphenyl)-2-thiazolyl]methyl}-4-oxo-, ethyl ester ;
Ethyl 2-(3-{[4-(4-methylphenyl)-1,3-thiazol-2-yl]methyl}-4-oxophthalazin-1-yl)acetate

Formula: C23H21N3O3S

Spectral Data

Ethyl 2-(3-{[4-(4-methylphenyl)-1,3-thiazol-2-yl]methyl}-4-oxo-3,4-dihydrophthalazin-1-yl)acetate 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 119
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 9/19/2017 10:38:15 AM
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Identificators

InChI InChI=1S/C23H21N3O3S/c1-3-29-22(27)12-19-17-6-4-5-7-18(17)23(28)26(25-19)13-21-24-20(14-30-21)16-10-8-15(2)9-11-16/h4-11,14H,3,12-13H2,1-2H3
InChI Key UDZNHPYAZSXRTI-UHFFFAOYSA-N
Canonical SMILES CCOC(=O)CC1=NN(C(=O)C2=CC=CC=C21)CC3=NC(=CS3)C4=CC=C(C=C4)C
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Other Names 1-Phthalazineacetic acid, 3,4-dihydro-3-{[4-(4-methylphenyl)-2-thiazolyl]methyl}-4-oxo-, ethyl ester ;
Ethyl 2-(3-{[4-(4-methylphenyl)-1,3-thiazol-2-yl]methyl}-4-oxophthalazin-1-yl)acetate

In Other Databases

ChemSpider 2023928
ChEMBL CHEMBL1422005
PubChem 2742397