Systematic / IUPAC Name: 4-[5-[[(1S,4S,5S)-4-[[4-(2-Methoxyethyl)piperazin-1-yl]methyl]-2-methyl-5-propan-2-ylcyclohex-2-en-1-yl]methyl]-1,3,4-oxadiazol-2-yl]-N,N-dimethylaniline
ID: Reference10551
Other Names:
Benzenamine, 4-[5-[[(1S,4S,5S)-4-[[4-(2-methoxyethyl)-1-piperazinyl]methyl]-2-methyl-5-(1-methylethyl)-2-cyclohexen-1-yl]methyl]-1,3,4-oxadiazol-2-yl]-N,N-dimethyl-;
NAT28-412660
Formula: C29H45N5O2
4-(5-{[(1S,4S,5S)-5-Isopropyl-4-{[4-(2-methoxyethyl)-1-piperazinyl]methyl}-2-methyl-2-cyclohexen-1-yl]methyl}-1,3,4-oxadiazol-2-yl)-N,N-dimethylaniline 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 | 1 |
No. of Spectra | 1670 |
Tandem Spectra | MS1, MS2, MS3, MS4 |
Ionization Methods | NSI |
Analyzers | FT |
Last Modification | 6/11/2021 10:49:55 AM |
InChI | InChI=1S/C29H45N5O2/c1-21(2)27-18-24(19-28-30-31-29(36-28)23-7-9-26(10-8-23)32(4)5)22(3)17-25(27)20-34-13-11-33(12-14-34)15-16-35-6/h7-10,17,21,24-25,27H,11-16,18-20H2,1-6H3/t24-,25-,27-/m0/s1 |
InChI Key | HURYJAHEAFBEBS-KLJDGLGGSA-N |
Canonical SMILES | CC1=CC(C(CC1CC2=NN=C(O2)C3=CC=C(C=C3)N(C)C)C(C)C)CN4CCN(CC4)CCOC |
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Other Names |
Benzenamine, 4-[5-[[(1S,4S,5S)-4-[[4-(2-methoxyethyl)-1-piperazinyl]methyl]-2-methyl-5-(1-methylethyl)-2-cyclohexen-1-yl]methyl]-1,3,4-oxadiazol-2-yl]-N,N-dimethyl-; NAT28-412660 |