(4S,6S)-N-[2-(Dimethylamino)ethyl]-6-isobutyl-1-(2-pyridinylmethyl)-3,4,5,6-tetrahydro-1H-azepino[5,4,3-cd]indole-4-carboxamide

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Systematic / IUPAC Name: (9S,11S)-N-[2-(Dimethylamino)ethyl]-9-(2-methylpropyl)-3-(pyridin-2-ylmethyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraene-11-carboxamide

ID: Reference10139

Other Names: 1H-Azepino[5,4,3-cd]indole-4-carboxamide, N-[2-(dimethylamino)ethyl]-3,4,5,6-tetrahydro-6-(2-methylpropyl)-1-(2-pyridinylmethyl)-, (4S,6S)-;
NAT33-501091

Formula: C26H35N5O

Spectral Data

(4S,6S)-N-[2-(Dimethylamino)ethyl]-6-isobutyl-1-(2-pyridinylmethyl)-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 133
Tandem Spectra MS1, MS2
Ionization Methods NSI
Analyzers FT
Last Modification 12/11/2020 11:05:37 AM
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Identificators

InChI InChI=1S/C26H35N5O/c1-18(2)14-22-21-9-7-10-24-25(21)19(16-31(24)17-20-8-5-6-11-27-20)15-23(29-22)26(32)28-12-13-30(3)4/h5-11,16,18,22-23,29H,12-15,17H2,1-4H3,(H,28,32)/t22-,23-/m0/s1
InChI Key LFLAJRQBMUIXBC-GOTSBHOMSA-N
Canonical SMILES CC(C)CC1C2=C3C(=CN(C3=CC=C2)CC4=CC=CC=N4)CC(N1)C(=O)NCCN(C)C
CAS
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Other Names 1H-Azepino[5,4,3-cd]indole-4-carboxamide, N-[2-(dimethylamino)ethyl]-3,4,5,6-tetrahydro-6-(2-methylpropyl)-1-(2-pyridinylmethyl)-, (4S,6S)-;
NAT33-501091

In Other Databases

PubChem 51138058
ChemSpider 29850993