Nα-{[(2R)-1-(cyclohexylcarbonyl)-4-(methylsulfonyl)-2-piperazinyl]carbonyl}-D-tryptophanamide

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Systematic / IUPAC Name: (2R)-N-[(2R)-1-Amino-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-1-(cyclohexanecarbonyl)-4-methylsulfonylpiperazine-2-carboxamide

ID: Reference9407

Other Names: 1H-Indole-3-propanamide, α-[[[(2R)-1-(cyclohexylcarbonyl)-4-(methylsulfonyl)-2-piperazinyl]carbonyl]amino]-, (αR)-;
NAT9-312853

Formula: C24H33N5O5S

Spectral Data

Nα-{[(2R)-1-(cyclohexylcarbonyl)-4-(methylsulfonyl)-2-piperazinyl]carbonyl}-D-tryptophanamide 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 Orbitrap Fusion Lumos with ETD LBP FAIMS
No. of Spectral Trees 1
No. of Spectra 1757
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 2/24/2020 12:39:20 PM
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Identificators

InChI InChI=1S/C24H33N5O5S/c1-35(33,34)28-11-12-29(24(32)16-7-3-2-4-8-16)21(15-28)23(31)27-20(22(25)30)13-17-14-26-19-10-6-5-9-18(17)19/h5-6,9-10,14,16,20-21,26H,2-4,7-8,11-13,15H2,1H3,(H2,25,30)(H,27,31)/t20-,21-/m1/s1
InChI Key WLXYXQZXSIXNTG-NHCUHLMSSA-N
Canonical SMILES CS(=O)(=O)N1CCN(C(C1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)N)C(=O)C4CCCCC4
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Other Names 1H-Indole-3-propanamide, α-[[[(2R)-1-(cyclohexylcarbonyl)-4-(methylsulfonyl)-2-piperazinyl]carbonyl]amino]-, (αR)-;
NAT9-312853

In Other Databases

ChemSpider 5503406
PubChem 7165012