N-{(4R,7S,8aS)-4-[3-(Benzylamino)-3-oxopropyl]-1-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}-4-(dimethylamino)benzamide

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Systematic / IUPAC Name: N-[(4R,7S,8aS)-4-[3-(Benzylamino)-3-oxopropyl]-1-oxo-3,4,6,7,8,8a-hexahydro-2H-pyrrolo[1,2-a]pyrazin-7-yl]-4-(dimethylamino)benzamide

ID: Reference9383

Other Names: Pyrrolo[1,2-a]pyrazine-4-propanamide, 7-[[4-(dimethylamino)benzoyl]amino]octahydro-1-oxo-N-(phenylmethyl)-, (4R,7S,8aS)-;
NAT23-379485

Formula: C26H33N5O3

Spectral Data

N-{(4R,7S,8aS)-4-[3-(Benzylamino)-3-oxopropyl]-1-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}-4-(dimethylamino)benzamide 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
No. of Spectral Trees 1
No. of Spectra 2512
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6, MS7
Ionization Methods NSI
Analyzers FT
Last Modification 2/17/2020 8:35:41 AM
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Identificators

InChI InChI=1S/C26H33N5O3/c1-30(2)21-10-8-19(9-11-21)25(33)29-20-14-23-26(34)28-16-22(31(23)17-20)12-13-24(32)27-15-18-6-4-3-5-7-18/h3-11,20,22-23H,12-17H2,1-2H3,(H,27,32)(H,28,34)(H,29,33)/t20-,22+,23-/m0/s1
InChI Key TUXJSCZHIUABFS-WWNPGLIZSA-N
Canonical SMILES CN(C)C1=CC=C(C=C1)C(=O)NC2CC3C(=O)NCC(N3C2)CCC(=O)NCC4=CC=CC=C4
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Other Names Pyrrolo[1,2-a]pyrazine-4-propanamide, 7-[[4-(dimethylamino)benzoyl]amino]octahydro-1-oxo-N-(phenylmethyl)-, (4R,7S,8aS)-;
NAT23-379485

In Other Databases

ChemSpider 21382551
PubChem 26762299