Systematic / IUPAC Name: N-[(1S,4S)-4-[1-(4-tert-Butylphenyl)-3,5-dimethylpyrazol-4-yl]cyclopent-2-en-1-yl]thiophene-2-carboxamide
ID: Reference10116
Other Names:
2-Thiophenecarboxamide, N-[(1S,4S)-4-[1-[4-(1,1-dimethylethyl)phenyl]-3,5-dimethyl-1H-pyrazol-4-yl]-2-cyclopenten-1-yl]-;
NAT16-377635
Formula: C25H29N3OS
N-[(1S,4S)-4-{3,5-Dimethyl-1-[4-(2-methyl-2-propanyl)phenyl]-1H-pyrazol-4-yl}-2-cyclopenten-1-yl]-2-thiophenecarboxamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Fusion Lumos with ETD LBP |
No. of Spectral Trees | 2 |
No. of Spectra | 3149 |
Tandem Spectra | MS1, MS2, MS3, MS4, MS5, MS6 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 12/4/2020 10:38:39 AM |
InChI | InChI=1S/C25H29N3OS/c1-16-23(18-8-11-20(15-18)26-24(29)22-7-6-14-30-22)17(2)28(27-16)21-12-9-19(10-13-21)25(3,4)5/h6-14,18,20H,15H2,1-5H3,(H,26,29)/t18-,20-/m1/s1 |
InChI Key | JLLXGSAJXYSECP-UYAOXDASSA-N |
Canonical SMILES | CC1=C(C(=NN1C2=CC=C(C=C2)C(C)(C)C)C)C3CC(C=C3)NC(=O)C4=CC=CS4 |
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Other Names |
2-Thiophenecarboxamide, N-[(1S,4S)-4-[1-[4-(1,1-dimethylethyl)phenyl]-3,5-dimethyl-1H-pyrazol-4-yl]-2-cyclopenten-1-yl]-; NAT16-377635 |