(2S)-N-[(2S)-1-Amino-3-cyclohexyl-1-oxo-2-propanyl]-1-(cyclohexylcarbonyl)-4-[4-(dimethylamino)benzoyl]-2-piperazinecarboxamide

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Systematic / IUPAC Name: (2S)-N-[(2S)-1-Amino-3-cyclohexyl-1-oxopropan-2-yl]-1-(cyclohexanecarbonyl)-4-[4-(dimethylamino)benzoyl]piperazine-2-carboxamide

ID: Reference10260

Other Names: 2-Piperazinecarboxamide, N-[(1S)-2-amino-1-(cyclohexylmethyl)-2-oxoethyl]-1-(cyclohexylcarbonyl)-4-[4-(dimethylamino)benzoyl]-, (2S)-;
NAT9-312550

Formula: C30H45N5O4

Spectral Data

(2S)-N-[(2S)-1-Amino-3-cyclohexyl-1-oxo-2-propanyl]-1-(cyclohexylcarbonyl)-4-[4-(dimethylamino)benzoyl]-2-piperazinecarboxamide mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 1383
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 2/26/2021 1:42:05 PM
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Identificators

InChI InChI=1S/C30H45N5O4/c1-33(2)24-15-13-23(14-16-24)29(38)34-17-18-35(30(39)22-11-7-4-8-12-22)26(20-34)28(37)32-25(27(31)36)19-21-9-5-3-6-10-21/h13-16,21-22,25-26H,3-12,17-20H2,1-2H3,(H2,31,36)(H,32,37)/t25-,26-/m0/s1
InChI Key GIDTWFHDEFGGHA-UIOOFZCWSA-N
Canonical SMILES CN(C)C1=CC=C(C=C1)C(=O)N2CCN(C(C2)C(=O)NC(CC3CCCCC3)C(=O)N)C(=O)C4CCCCC4
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Other Names 2-Piperazinecarboxamide, N-[(1S)-2-amino-1-(cyclohexylmethyl)-2-oxoethyl]-1-(cyclohexylcarbonyl)-4-[4-(dimethylamino)benzoyl]-, (2S)-;
NAT9-312550

In Other Databases

PubChem 45361700
ChemSpider 22806773