N-[(1R,9S)-6-Oxo-11-(phenoxyacetyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]-2-thiophenecarboxamide

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Systematic / IUPAC Name: N-[(1R,9S)-6-Oxo-11-(2-phenoxyacetyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]thiophene-2-carboxamide

ID: Reference10941

Other Names: 2-Thiophenecarboxamide, N-[(1R,5S)-1,3,4,5,6,8-hexahydro-8-oxo-3-(2-phenoxyacetyl)-1,5-methano-2H-pyrido[1,2-a][1,5]diazocin-9-yl]-;
NAT11-274906

Formula: C24H23N3O4S

Spectral Data

N-[(1R,9S)-6-Oxo-11-(phenoxyacetyl)-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-5-yl]-2-thiophenecarboxamide 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 1115
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods NSI
Analyzers FT
Last Modification 10/15/2021 10:17:23 AM
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Identificators

InChI InChI=1S/C24H23N3O4S/c28-22(15-31-18-5-2-1-3-6-18)26-12-16-11-17(14-26)20-9-8-19(24(30)27(20)13-16)25-23(29)21-7-4-10-32-21/h1-10,16-17H,11-15H2,(H,25,29)/t16-,17+/m0/s1
InChI Key ZBBSTNPBGQMUEO-DLBZAZTESA-N
Canonical SMILES C1C2CN(CC1C3=CC=C(C(=O)N3C2)NC(=O)C4=CC=CS4)C(=O)COC5=CC=CC=C5
CAS
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Other Names 2-Thiophenecarboxamide, N-[(1R,5S)-1,3,4,5,6,8-hexahydro-8-oxo-3-(2-phenoxyacetyl)-1,5-methano-2H-pyrido[1,2-a][1,5]diazocin-9-yl]-;
NAT11-274906

In Other Databases

PubChem 7142730
ChemSpider 5484455