Systematic / IUPAC Name: Ethyl 4-[2-(4-chlorobenzoyl)hydrazino]-2-(2-thienyl)-5-pyrimidinecarboxylate
ID: Reference4640
Other Names: 5-Pyrimidinecarboxylic acid, 4-[2-(4-chlorobenzoyl)hydrazinyl]-2-(2-thienyl)-, ethyl ester
Formula: C18H15ClN4O3S
Ethyl 4-[2-(4-chlorobenzoyl)hydrazino]-2-(2-thienyl)pyrimidine-5-carboxylate mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
| 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 | 4/26/2016 7:41:25 AM |
| InChI | InChI=1S/C18H15ClN4O3S/c1-2-26-18(25)13-10-20-16(14-4-3-9-27-14)21-15(13)22-23-17(24)11-5-7-12(19)8-6-11/h3-10H,2H2,1H3,(H,23,24)(H,20,21,22) |
| InChI Key | DJDLIKORFZLXJH-UHFFFAOYSA-N |
| Canonical SMILES | CCOC(=O)C1=CN=C(N=C1NNC(=O)C2=CC=C(C=C2)Cl)C3=CC=CS3 |
| CAS | |
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| Other Names | 5-Pyrimidinecarboxylic acid, 4-[2-(4-chlorobenzoyl)hydrazinyl]-2-(2-thienyl)-, ethyl ester |