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

enlarge

Systematic / IUPAC Name: (9S,11S)-N-(2-Methoxyethyl)-3-[(5-methyl-1,2-oxazol-3-yl)methyl]-9-(2-methylpropyl)-3,10-diazatricyclo[6.4.1.04,13]trideca-1,4,6,8(13)-tetraene-11-carboxamide

ID: Reference10138

Other Names: 1H-Azepino[5,4,3-cd]indole-4-carboxamide, 3,4,5,6-tetrahydro-N-(2-methoxyethyl)-1-[(5-methyl-3-isoxazolyl)methyl]-6-(2-methylpropyl)-, (4S,6S)-;
NAT33-501383

Formula: C24H32N4O3

Spectral Data

(4S,6S)-6-Isobutyl-N-(2-methoxyethyl)-1-[(5-methyl-1,2-oxazol-3-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.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap Fusion Lumos with ETD LBP
No. of Spectral Trees 1
No. of Spectra 516
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 12/11/2020 11:04:22 AM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C24H32N4O3/c1-15(2)10-20-19-6-5-7-22-23(19)17(12-21(26-20)24(29)25-8-9-30-4)13-28(22)14-18-11-16(3)31-27-18/h5-7,11,13,15,20-21,26H,8-10,12,14H2,1-4H3,(H,25,29)/t20-,21-/m0/s1
InChI Key YBBGOAAXYAPTBI-SFTDATJTSA-N
Canonical SMILES CC1=CC(=NO1)CN2C=C3CC(NC(C4=C3C2=CC=C4)CC(C)C)C(=O)NCCOC
CAS
Splash
Other Names 1H-Azepino[5,4,3-cd]indole-4-carboxamide, 3,4,5,6-tetrahydro-N-(2-methoxyethyl)-1-[(5-methyl-3-isoxazolyl)methyl]-6-(2-methylpropyl)-, (4S,6S)-;
NAT33-501383

In Other Databases

ChemSpider 29851080
PubChem 51138146