(1R,9R)-N-(4-Fluorophenyl)-6-oxo-5-[(phenylcarbamoyl)amino]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide

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Systematic / IUPAC Name: (1R,9R)-N-(4-Fluorophenyl)-6-oxo-5-(phenylcarbamoylamino)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-carboxamide

ID: Reference10032

Other Names: 1,5-Methano-2H-pyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide, N-(4-fluorophenyl)-1,5,6,8-tetrahydro-8-oxo-9-[[(phenylamino)carbonyl]amino]-, (1R,5R)-;
NAT11-292389

Formula: C25H24FN5O3

Spectral Data

(1R,9R)-N-(4-Fluorophenyl)-6-oxo-5-[(phenylcarbamoyl)amino]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-diene-11-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 2597
Tandem Spectra MS1, MS2, MS3, MS4, MS5
Ionization Methods NSI
Analyzers FT
Last Modification 11/6/2020 1:20:29 PM
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Identificators

InChI InChI=1S/C25H24FN5O3/c26-18-6-8-20(9-7-18)28-25(34)30-13-16-12-17(15-30)22-11-10-21(23(32)31(22)14-16)29-24(33)27-19-4-2-1-3-5-19/h1-11,16-17H,12-15H2,(H,28,34)(H2,27,29,33)/t16-,17+/m0/s1
InChI Key RUMSEDIMQUBPNJ-DLBZAZTESA-N
Canonical SMILES C1C2CN(CC1C3=CC=C(C(=O)N3C2)NC(=O)NC4=CC=CC=C4)C(=O)NC5=CC=C(C=C5)F
CAS
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Other Names 1,5-Methano-2H-pyrido[1,2-a][1,5]diazocine-3(4H)-carboxamide, N-(4-fluorophenyl)-1,5,6,8-tetrahydro-8-oxo-9-[[(phenylamino)carbonyl]amino]-, (1R,5R)-;
NAT11-292389

In Other Databases

PubChem 11885929
ChemSpider 10060252