N-{(1S,4S)-4-[1-(4-Chloro-2-methylphenyl)-3,5-dimethyl-1H-pyrazol-4-yl]-2-cyclopenten-1-yl}-4-(dimethylamino)benzamide
12147
Reference
N-{(1S,4S)-4-[1-(4-Chloro-2-methylphenyl)-3,5-dimethyl-1H-pyrazol-4-yl]-2-cyclopenten-1-yl}-4-(dimethylamino)benzamide Structure
Systematic / IUPAC Name: N-[(1S,4S)-4-[1-(4-Chloro-2-methylphenyl)-3,5-dimethylpyrazol-4-yl]cyclopent-2-en-1-yl]-4-(dimethylamino)benzamide
ID: Reference12147
Other Names: NAT16-353394
Formula: C26H29ClN4O
Spectral Data
N-{(1S,4S)-4-[1-(4-Chloro-2-methylphenyl)-3,5-dimethyl-1H-pyrazol-4-yl]-2-cyclopenten-1-yl}-4-(dimethylamino)benzamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Available MS Data
| Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
| No. of Spectral Trees | 1 |
| No. of Spectra | 759 |
| Tandem Spectra | MS1, MS2, MS3, MS4 |
| Ionization Methods | NSI |
| Analyzers | FT |
| Last Modification | 1/16/2023 5:22:38 PM |
Identificators
| InChI | InChI=1S/C26H29ClN4O/c1-16-14-21(27)9-13-24(16)31-18(3)25(17(2)29-31)20-6-10-22(15-20)28-26(32)19-7-11-23(12-8-19)30(4)5/h6-14,20,22H,15H2,1-5H3,(H,28,32)/t20-,22-/m1/s1 |
| InChI Key | UZCPYPWNSMNQRR-IFMALSPDSA-N |
| Canonical SMILES | CC1=C(C=CC(=C1)Cl)N2C(=C(C(=N2)C)C3CC(C=C3)NC(=O)C4=CC=C(C=C4)N(C)C)C |
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| Splash | |
| Other Names | NAT16-353394 |