1-(3-Chlorophenyl)-3-{(4R,7S,8aS)-4-[3-(2,3-dihydro-1H-indol-1-yl)-3-oxopropyl]-1-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}urea

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

ID: Reference9473

Other Names: Urea, N-(3-chlorophenyl)-N'-[(4R,7S,8aS)-4-[3-(2,3-dihydro-1H-indol-1-yl)-3-oxopropyl]octahydro-1-oxopyrrolo[1,2-a]pyrazin-7-yl]-;
NAT23-379308

Formula: C25H28ClN5O3

Spectral Data

1-(3-Chlorophenyl)-3-{(4R,7S,8aS)-4-[3-(2,3-dihydro-1H-indol-1-yl)-3-oxopropyl]-1-oxooctahydropyrrolo[1,2-a]pyrazin-7-yl}urea 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 3226
Tandem Spectra MS1, MS2, MS3, MS4, MS5, MS6
Ionization Methods NSI
Analyzers FT
Last Modification 3/11/2020 10:26:59 AM
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Identificators

InChI InChI=1S/C25H28ClN5O3/c26-17-5-3-6-18(12-17)28-25(34)29-19-13-22-24(33)27-14-20(31(22)15-19)8-9-23(32)30-11-10-16-4-1-2-7-21(16)30/h1-7,12,19-20,22H,8-11,13-15H2,(H,27,33)(H2,28,29,34)/t19-,20+,22-/m0/s1
InChI Key AKZXAYBHFFROGZ-VWPQPMDRSA-N
Canonical SMILES C1CN(C2=CC=CC=C21)C(=O)CCC3CNC(=O)C4N3CC(C4)NC(=O)NC5=CC(=CC=C5)Cl
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Other Names Urea, N-(3-chlorophenyl)-N'-[(4R,7S,8aS)-4-[3-(2,3-dihydro-1H-indol-1-yl)-3-oxopropyl]octahydro-1-oxopyrrolo[1,2-a]pyrazin-7-yl]-;
NAT23-379308

In Other Databases

ChemSpider 21382472
PubChem 26762210