(4S,6S)-6-Isobutyl-N-isopropyl-1-[(1-methyl-1H-imidazol-2-yl)methyl]-3,4,5,6-tetrahydro-1H-azepino[5,4,3-cd]indole-4-carboxamide

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Systematic / IUPAC Name: (9S,11S)-3-[(1-Methylimidazol-2-yl)methyl]-9-(2-methylpropyl)-N-propan-2-yl-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraene-11-carboxamide

ID: Reference11679

Other Names: NAT33-501202

Formula: C24H33N5O

Spectral Data

(4S,6S)-6-Isobutyl-N-isopropyl-1-[(1-methyl-1H-imidazol-2-yl)methyl]-3,4,5,6-tetrahydro-1H-azepino[5,4,3-cd]indole-4-carboxamide 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 3270
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 8/22/2022 8:33:38 AM
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Identificators

InChI InChI=1S/C24H33N5O/c1-15(2)11-19-18-7-6-8-21-23(18)17(12-20(27-19)24(30)26-16(3)4)13-29(21)14-22-25-9-10-28(22)5/h6-10,13,15-16,19-20,27H,11-12,14H2,1-5H3,(H,26,30)/t19-,20-/m0/s1
InChI Key CNHBYSCKPCQAJZ-PMACEKPBSA-N
Canonical SMILES CC(C)CC1C2=C3C(=CN(C3=CC=C2)CC4=NC=CN4C)CC(N1)C(=O)NC(C)C
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Other Names NAT33-501202

In Other Databases

ChemSpider 29851028
PubChem 51138093